9-(3-acetamido-3,4-dihydro-2H-quinolin-1-yl)-5-azanyl-N-butyl-2,7,7-trimethyl-4-oxidanyl-9-oxidanylidene-nonanamide

Systemtic Name: 9-(3-acetamido-3,4-dihydro-2H-quinolin-1-yl)-5-azanyl-N-butyl-2,7,7-trimethyl-4-oxidanyl-9-oxidanylidene-nonanamide Openeye Name: 9-(3-acetamido-3,4-dihydro-2H-quinolin-1-yl)-5-amino-N-butyl-4-hydroxy-2,7,7-trimethyl-9-oxo-nonanamide CAS Name: 9-(3-acetamido-3,4-dihydro-2H-quinolin-1-yl)-5-amino-N-butyl-4-hydroxy-2,7,7-trimethyl-9-oxononanamide IUPAC Name: 9-(3-acetamido-3,4-dihydro-2H-quinolin-1-yl)-5-amino-N-butyl-4-hydroxy-2,7,7-trimethyl-9-oxononanamide Traditional Name: 9-(3-acetamido-3,4-dihydro-2H-quinolin-1-yl)-5-amino-N-butyl-4-hydroxy-9-keto-2,7,7-trimethyl-pelargonamide Formula: C27H44N4O4 MolecularWeight: 488.66266

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(C)CC(C(CC(C)(C)CC(=O)N1CC(CC2=CC=CC=C21)NC(=O)C)N)O

Isomeric SMILES

CCCCNC(=O)C(C)CC(C(CC(C)(C)CC(=O)N1CC(CC2=CC=CC=C21)NC(=O)C)N)O

InChI

InChI=1S/C27H44N4O4/c1-6-7-12-29-26(35)18(2)13-24(33)22(28)15-27(4,5)16-25(34)31-17-21(30-19(3)32)14-20-10-8-9-11-23(20)31/h8-11,18,21-22,24,33H,6-7,12-17,28H2,1-5H3,(H,29,35)(H,30,32)