6-methoxy-1-(3,4,6-trimethylcyclohex-3-en-1-yl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium chloride

Systemtic Name: 6-methoxy-1-(3,4,6-trimethylcyclohex-3-en-1-yl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium chloride Openeye Name: 6-methoxy-1-(3,4,6-trimethylcyclohex-3-en-1-yl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium chloride CAS Name: 6-methoxy-1-(3,4,6-trimethyl-1-cyclohex-3-enyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium chloride IUPAC Name: 6-methoxy-1-(3,4,6-trimethylcyclohex-3-en-1-yl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium chloride Traditional Name: 6-methoxy-1-(3,4,6-trimethylcyclohex-3-en-1-yl)-2,3,4,9-tetrahydro-1H-$b-carbolin-2-ium chloride Formula: C21H29ClN2O MolecularWeight: 360.92076

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=C(CC1C2C3=C(CC[NH2+]2)C4=C(N3)C=CC(=C4)OC)C)C.[Cl-]

Isomeric SMILES

CC1CC(=C(CC1C2C3=C(CC[NH2+]2)C4=C(N3)C=CC(=C4)OC)C)C.[Cl-]

InChI

InChI=1S/C21H28N2O.ClH/c1-12-9-14(3)17(10-13(12)2)20-21-16(7-8-22-20)18-11-15(24-4)5-6-19(18)23-21;/h5-6,11,14,17,20,22-23H,7-10H2,1-4H3;1H