[3-(6-chloranylhexanoylamino)-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl]-(phenylmethyl)carbamic acid

Systemtic Name: [3-(6-chloranylhexanoylamino)-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl]-(phenylmethyl)carbamic acid Openeye Name: benzyl-[3-(6-chlorohexanoylamino)-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl]carbamic acid CAS Name: [3-[(6-chloro-1-oxohexyl)amino]-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl]-(phenylmethyl)carbamic acid IUPAC Name: benzyl-[3-(6-chlorohexanoylamino)-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl]carbamic acid Traditional Name: benzyl-[3-(6-chlorohexanoylamino)-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl]carbamic acid Formula: C29H38ClN3O5 MolecularWeight: 544.08212

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C3CC(C(CN3CCC2=C1)NC(=O)CCCCCCl)N(CC4=CC=CC=C4)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C2C3CC(C(CN3CCC2=C1)NC(=O)CCCCCCl)N(CC4=CC=CC=C4)C(=O)O)OC

InChI

InChI=1S/C29H38ClN3O5/c1-37-26-15-21-12-14-32-19-23(31-28(34)11-7-4-8-13-30)25(17-24(32)22(21)16-27(26)38-2)33(29(35)36)18-20-9-5-3-6-10-20/h3,5-6,9-10,15-16,23-25H,4,7-8,11-14,17-19H2,1-2H3,(H,31,34)(H,35,36)