2-methoxy-4-[1-[[4-(phenylmethyl)piperazin-4-ium-1-yl]amino]ethylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 2-methoxy-4-[1-[[4-(phenylmethyl)piperazin-4-ium-1-yl]amino]ethylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[1-[(4-benzylpiperazin-4-ium-1-yl)amino]ethylidene]-2-methoxy-cyclohexa-2,5-dien-1-one CAS Name: 2-methoxy-4-[1-[[4-(phenylmethyl)-1-piperazin-4-iumyl]amino]ethylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[1-[(4-benzylpiperazin-4-ium-1-yl)amino]ethylidene]-2-methoxycyclohexa-2,5-dien-1-one Traditional Name: 4-[1-[(4-benzylpiperazin-4-ium-1-yl)amino]ethylidene]-2-methoxy-cyclohexa-2,5-dien-1-one Formula: C20H26N3O2+ MolecularWeight: 340.43934

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C=CC(=O)C(=C1)OC)NN2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

CC(=C1C=CC(=O)C(=C1)OC)NN2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C20H25N3O2/c1-16(18-8-9-19(24)20(14-18)25-2)21-23-12-10-22(11-13-23)15-17-6-4-3-5-7-17/h3-9,14,21H,10-13,15H2,1-2H3/p+1