[1-[(2-methoxyphenyl)methyl]indol-3-yl] N-[4-azanyl-8-(butylamino)-7-methyl-5-oxidanyl-8-oxidanylidene-2-propan-2-yl-octyl]carbamate

Systemtic Name: [1-[(2-methoxyphenyl)methyl]indol-3-yl] N-[4-azanyl-8-(butylamino)-7-methyl-5-oxidanyl-8-oxidanylidene-2-propan-2-yl-octyl]carbamate Openeye Name: [1-[(2-methoxyphenyl)methyl]indol-3-yl] N-[4-amino-8-(butylamino)-5-hydroxy-2-isopropyl-7-methyl-8-oxo-octyl]carbamate CAS Name: N-[4-amino-8-(butylamino)-5-hydroxy-7-methyl-8-oxo-2-propan-2-yloctyl]carbamic acid [1-[(2-methoxyphenyl)methyl]-3-indolyl] ester IUPAC Name: [1-[(2-methoxyphenyl)methyl]indol-3-yl] N-[4-amino-8-(butylamino)-5-hydroxy-7-methyl-8-oxo-2-propan-2-yloctyl]carbamate Traditional Name: N-[4-amino-8-(butylamino)-5-hydroxy-2-isopropyl-8-keto-7-methyl-octyl]carbamic acid (1-o-anisylindol-3-yl) ester Formula: C33H48N4O5 MolecularWeight: 580.75802

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(C)CC(C(CC(CNC(=O)OC1=CN(C2=CC=CC=C21)CC3=CC=CC=C3OC)C(C)C)N)O

Isomeric SMILES

CCCCNC(=O)C(C)CC(C(CC(CNC(=O)OC1=CN(C2=CC=CC=C21)CC3=CC=CC=C3OC)C(C)C)N)O

InChI

InChI=1S/C33H48N4O5/c1-6-7-16-35-32(39)23(4)17-29(38)27(34)18-25(22(2)3)19-36-33(40)42-31-21-37(28-14-10-9-13-26(28)31)20-24-12-8-11-15-30(24)41-5/h8-15,21-23,25,27,29,38H,6-7,16-20,34H2,1-5H3,(H,35,39)(H,36,40)