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

Systemtic Name: [3-(4-chloranylpentanoylamino)-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl]carbamic acid Openeye Name: [3-(4-chloropentanoylamino)-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl]carbamic acid CAS Name: [3-[(4-chloro-1-oxopentyl)amino]-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl]carbamic acid IUPAC Name: [3-(4-chloropentanoylamino)-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl]carbamic acid Traditional Name: [3-(4-chloropentanoylamino)-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl]carbamic acid Formula: C21H30ClN3O5 MolecularWeight: 439.933

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(=O)NC1CN2CCC3=CC(=C(C=C3C2CC1NC(=O)O)OC)OC)Cl

Isomeric SMILES

CC(CCC(=O)NC1CN2CCC3=CC(=C(C=C3C2CC1NC(=O)O)OC)OC)Cl

InChI

InChI=1S/C21H30ClN3O5/c1-12(22)4-5-20(26)23-16-11-25-7-6-13-8-18(29-2)19(30-3)9-14(13)17(25)10-15(16)24-21(27)28/h8-9,12,15-17,24H,4-7,10-11H2,1-3H3,(H,23,26)(H,27,28)