(4-chlorophenyl)-(5-methoxy-1,2-dimethyl-indol-1-ium-1-yl)methanone; methanolate

Systemtic Name: (4-chlorophenyl)-(5-methoxy-1,2-dimethyl-indol-1-ium-1-yl)methanone; methanolate Openeye Name: (4-chlorophenyl)-(5-methoxy-1,2-dimethyl-indol-1-ium-1-yl)methanone; methanolate CAS Name: (4-chlorophenyl)-(5-methoxy-1,2-dimethyl-1-indol-1-iumyl)methanone; methanolate IUPAC Name: (4-chlorophenyl)-(5-methoxy-1,2-dimethylindol-1-ium-1-yl)methanone; methanolate Traditional Name: (4-chlorophenyl)-(5-methoxy-1,2-dimethyl-indol-1-ium-1-yl)methanone; methanolate Formula: C19H20ClNO3 MolecularWeight: 345.82

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C([N+]1(C)C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC.C[O-]

Isomeric SMILES

CC1=CC2=C([N+]1(C)C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC.C[O-]

InChI

InChI=1S/C18H17ClNO2.CH3O/c1-12-10-14-11-16(22-3)8-9-17(14)20(12,2)18(21)13-4-6-15(19)7-5-13;1-2/h4-11H,1-3H3;1H3/q+1;-1