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

Systemtic Name: 6-[[[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]amino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: 6-[[[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]amino]methylene]cyclohexa-2,4-dien-1-one CAS Name: 6-[[[1-[(4-chlorophenyl)methyl]-4-piperidin-1-iumyl]amino]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]amino]methylidene]cyclohexa-2,4-dien-1-one Traditional Name: 6-[[[1-(4-chlorobenzyl)piperidin-1-ium-4-yl]amino]methylene]cyclohexa-2,4-dien-1-one Formula: C19H22ClN2O+ MolecularWeight: 329.84378

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC=C2C=CC=CC2=O)CC3=CC=C(C=C3)Cl

Isomeric SMILES

C1C[NH+](CCC1NC=C2C=CC=CC2=O)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H21ClN2O/c20-17-7-5-15(6-8-17)14-22-11-9-18(10-12-22)21-13-16-3-1-2-4-19(16)23/h1-8,13,18,21H,9-12,14H2/p+1