16-azanyl-13-butan-2-yl-20-[(4-methoxyphenyl)methyl]-6,17,21-trimethyl-3-(2-methylpropyl)-12-oxidanyl-8-propan-2-yl-9,18-dioxa-1,4,14,21-tetrazabicyclo[21.3.0]hexacosane-2,5,7,10,15,19,22-heptone

Systemtic Name: 16-azanyl-13-butan-2-yl-20-[(4-methoxyphenyl)methyl]-6,17,21-trimethyl-3-(2-methylpropyl)-12-oxidanyl-8-propan-2-yl-9,18-dioxa-1,4,14,21-tetrazabicyclo[21.3.0]hexacosane-2,5,7,10,15,19,22-heptone Openeye Name: 16-amino-12-hydroxy-3-isobutyl-8-isopropyl-20-[(4-methoxyphenyl)methyl]-6,17,21-trimethyl-13-sec-butyl-9,18-dioxa-1,4,14,21-tetrazabicyclo[21.3.0]hexacosane-2,5,7,10,15,19,22-heptone CAS Name: 16-amino-13-butan-2-yl-12-hydroxy-20-[(4-methoxyphenyl)methyl]-6,17,21-trimethyl-3-(2-methylpropyl)-8-propan-2-yl-9,18-dioxa-1,4,14,21-tetrazabicyclo[21.3.0]hexacosane-2,5,7,10,15,19,22-heptone IUPAC Name: 16-amino-13-butan-2-yl-12-hydroxy-20-[(4-methoxyphenyl)methyl]-6,17,21-trimethyl-3-(2-methylpropyl)-8-propan-2-yl-9,18-dioxa-1,4,14,21-tetrazabicyclo[21.3.0]hexacosane-2,5,7,10,15,19,22-heptone Traditional Name: 16-amino-12-hydroxy-3-isobutyl-8-isopropyl-6,17,21-trimethyl-20-p-anisyl-13-sec-butyl-9,18-dioxa-1,4,14,21-tetrazabicyclo[21.3.0]hexacosane-2,5,7,10,15,19,22-heptone Formula: C42H65N5O11 MolecularWeight: 815.9924

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1C(CC(=O)OC(C(=O)C(C(=O)NC(C(=O)N2CCCC2C(=O)N(C(C(=O)OC(C(C(=O)N1)N)C)CC3=CC=C(C=C3)OC)C)CC(C)C)C)C(C)C)O

Isomeric SMILES

CCC(C)C1C(CC(=O)OC(C(=O)C(C(=O)NC(C(=O)N2CCCC2C(=O)N(C(C(=O)OC(C(C(=O)N1)N)C)CC3=CC=C(C=C3)OC)C)CC(C)C)C)C(C)C)O

InChI

InChI=1S/C42H65N5O11/c1-11-24(6)35-32(48)21-33(49)58-37(23(4)5)36(50)25(7)38(51)44-29(19-22(2)3)40(53)47-18-12-13-30(47)41(54)46(9)31(20-27-14-16-28(56-10)17-15-27)42(55)57-26(8)34(43)39(52)45-35/h14-17,22-26,29-32,34-35,37,48H,11-13,18-21,43H2,1-10H3,(H,44,51)(H,45,52)