4-chloranyl-3,5-dimethyl-6-[[(4-piperazin-4-ium-1-ylphenyl)amino]methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 4-chloranyl-3,5-dimethyl-6-[[(4-piperazin-4-ium-1-ylphenyl)amino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: 4-chloro-3,5-dimethyl-6-[(4-piperazin-4-ium-1-ylanilino)methylene]cyclohexa-2,4-dien-1-one CAS Name: 4-chloro-3,5-dimethyl-6-[[4-(1-piperazin-4-iumyl)anilino]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 4-chloro-3,5-dimethyl-6-[(4-piperazin-4-ium-1-ylanilino)methylidene]cyclohexa-2,4-dien-1-one Traditional Name: 4-chloro-3,5-dimethyl-6-[(4-piperazin-4-ium-1-ylanilino)methylene]cyclohexa-2,4-dien-1-one Formula: C19H23ClN3O+ MolecularWeight: 344.85842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=CNC2=CC=C(C=C2)N3CC[NH2+]CC3)C(=C1Cl)C

Isomeric SMILES

CC1=CC(=O)C(=CNC2=CC=C(C=C2)N3CC[NH2+]CC3)C(=C1Cl)C

InChI

InChI=1S/C19H22ClN3O/c1-13-11-18(24)17(14(2)19(13)20)12-22-15-3-5-16(6-4-15)23-9-7-21-8-10-23/h3-6,11-12,21-22H,7-10H2,1-2H3/p+1