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

Systemtic Name: 5-azanyl-N-butyl-9-[3-(dimethylcarbamoylamino)-3,4-dihydro-2H-quinolin-1-yl]-2,7,7-trimethyl-4-oxidanyl-9-oxidanylidene-nonanamide Openeye Name: 5-amino-N-butyl-9-[3-(dimethylcarbamoylamino)-3,4-dihydro-2H-quinolin-1-yl]-4-hydroxy-2,7,7-trimethyl-9-oxo-nonanamide CAS Name: 5-amino-N-butyl-9-[3-[[dimethylamino(oxo)methyl]amino]-3,4-dihydro-2H-quinolin-1-yl]-4-hydroxy-2,7,7-trimethyl-9-oxononanamide IUPAC Name: 5-amino-N-butyl-9-[3-(dimethylcarbamoylamino)-3,4-dihydro-2H-quinolin-1-yl]-4-hydroxy-2,7,7-trimethyl-9-oxononanamide Traditional Name: 5-amino-N-butyl-9-[3-(dimethylcarbamoylamino)-3,4-dihydro-2H-quinolin-1-yl]-4-hydroxy-9-keto-2,7,7-trimethyl-pelargonamide Formula: C28H47N5O4 MolecularWeight: 517.70388

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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)N(C)C)N)O

Isomeric SMILES

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

InChI

InChI=1S/C28H47N5O4/c1-7-8-13-30-26(36)19(2)14-24(34)22(29)16-28(3,4)17-25(35)33-18-21(31-27(37)32(5)6)15-20-11-9-10-12-23(20)33/h9-12,19,21-22,24,34H,7-8,13-18,29H2,1-6H3,(H,30,36)(H,31,37)