(3R,10S,13S,16S,19S)-16-[(2S)-butan-2-yl]-3,10,11,14-tetramethyl-13-propan-2-yl-4-oxa-1,8,11,14,17-pentazabicyclo[17.3.0]docosane-2,5,9,12,15,18-hexone

Systemtic Name: (3R,10S,13S,16S,19S)-16-[(2S)-butan-2-yl]-3,10,11,14-tetramethyl-13-propan-2-yl-4-oxa-1,8,11,14,17-pentazabicyclo[17.3.0]docosane-2,5,9,12,15,18-hexone Openeye Name: (3R,10S,13S,16S,19S)-13-isopropyl-3,10,11,14-tetramethyl-16-[(1S)-1-methylpropyl]-4-oxa-1,8,11,14,17-pentazabicyclo[17.3.0]docosane-2,5,9,12,15,18-hexone CAS Name: (3R,10S,13S,16S,19S)-16-[(2S)-butan-2-yl]-3,10,11,14-tetramethyl-13-propan-2-yl-4-oxa-1,8,11,14,17-pentazabicyclo[17.3.0]docosane-2,5,9,12,15,18-hexone IUPAC Name: (3R,10S,13S,16S,19S)-16-[(2S)-butan-2-yl]-3,10,11,14-tetramethyl-13-propan-2-yl-4-oxa-1,8,11,14,17-pentazabicyclo[17.3.0]docosane-2,5,9,12,15,18-hexone Traditional Name: (3R,10S,13S,16S,19S)-13-isopropyl-3,10,11,14-tetramethyl-16-[(1S)-1-methylpropyl]-4-oxa-1,8,11,14,17-pentazabicyclo[17.3.0]docosane-2,5,9,12,15,18-triquinone Formula: C27H45N5O7 MolecularWeight: 551.6755

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1C(=O)N(C(C(=O)N(C(C(=O)NCCC(=O)OC(C(=O)N2CCCC2C(=O)N1)C)C)C)C(C)C)C

Isomeric SMILES

CC[C@H](C)[C@H]1C(=O)N([C@H](C(=O)N([C@H](C(=O)NCCC(=O)O[C@@H](C(=O)N2CCC[C@H]2C(=O)N1)C)C)C)C(C)C)C

InChI

InChI=1S/C27H45N5O7/c1-9-16(4)21-26(37)31(8)22(15(2)3)27(38)30(7)17(5)23(34)28-13-12-20(33)39-18(6)25(36)32-14-10-11-19(32)24(35)29-21/h15-19,21-22H,9-14H2,1-8H3,(H,28,34)(H,29,35)/t16-,17-,18+,19-,21-,22-/m0/s1