(6Z)-6-[[[4-(phenylmethyl)piperazin-1-yl]amino]methylidene]-2-prop-2-enyl-cyclohexa-2,4-dien-1-one

Systemtic Name: (6Z)-6-[[[4-(phenylmethyl)piperazin-1-yl]amino]methylidene]-2-prop-2-enyl-cyclohexa-2,4-dien-1-one Openeye Name: (6Z)-2-allyl-6-[[(4-benzylpiperazin-1-yl)amino]methylene]cyclohexa-2,4-dien-1-one CAS Name: (6Z)-6-[[[4-(phenylmethyl)-1-piperazinyl]amino]methylidene]-2-prop-2-enyl-1-cyclohexa-2,4-dienone IUPAC Name: (6Z)-6-[[(4-benzylpiperazin-1-yl)amino]methylidene]-2-prop-2-enylcyclohexa-2,4-dien-1-one Traditional Name: (6Z)-2-allyl-6-[[(4-benzylpiperazino)amino]methylene]cyclohexa-2,4-dien-1-one Formula: C21H25N3O MolecularWeight: 335.4427

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=CC=CC(=CNN2CCN(CC2)CC3=CC=CC=C3)C1=O

Isomeric SMILES

C=CCC1=CC=C/C(=C/NN2CCN(CC2)CC3=CC=CC=C3)/C1=O

InChI

InChI=1S/C21H25N3O/c1-2-7-19-10-6-11-20(21(19)25)16-22-24-14-12-23(13-15-24)17-18-8-4-3-5-9-18/h2-6,8-11,16,22H,1,7,12-15,17H2/b20-16-