6-[[[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]amino]methylidene]-2-methoxy-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]amino]methylidene]-2-methoxy-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]amino]methylene]-2-methoxy-cyclohexa-2,4-dien-1-one CAS Name: 6-[[[1-[(4-chlorophenyl)methyl]-4-piperidin-1-iumyl]amino]methylidene]-2-methoxy-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]amino]methylidene]-2-methoxycyclohexa-2,4-dien-1-one Traditional Name: 6-[[[1-(4-chlorobenzyl)piperidin-1-ium-4-yl]amino]methylene]-2-methoxy-cyclohexa-2,4-dien-1-one Formula: C20H24ClN2O2+ MolecularWeight: 359.86976

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=CNC2CC[NH+](CC2)CC3=CC=C(C=C3)Cl)C1=O

Isomeric SMILES

COC1=CC=CC(=CNC2CC[NH+](CC2)CC3=CC=C(C=C3)Cl)C1=O

InChI

InChI=1S/C20H23ClN2O2/c1-25-19-4-2-3-16(20(19)24)13-22-18-9-11-23(12-10-18)14-15-5-7-17(21)8-6-15/h2-8,13,18,22H,9-12,14H2,1H3/p+1