(6Z)-6-[(cyclopentylamino)methylidene]-4-nitro-2-(2-phenylpropan-2-yl)cyclohexa-2,4-dien-1-one

Systemtic Name: (6Z)-6-[(cyclopentylamino)methylidene]-4-nitro-2-(2-phenylpropan-2-yl)cyclohexa-2,4-dien-1-one Openeye Name: (6Z)-6-[(cyclopentylamino)methylene]-2-(1-methyl-1-phenyl-ethyl)-4-nitro-cyclohexa-2,4-dien-1-one CAS Name: (6Z)-6-[(cyclopentylamino)methylidene]-4-nitro-2-(2-phenylpropan-2-yl)-1-cyclohexa-2,4-dienone IUPAC Name: (6Z)-6-[(cyclopentylamino)methylidene]-4-nitro-2-(2-phenylpropan-2-yl)cyclohexa-2,4-dien-1-one Traditional Name: (6Z)-2-cumyl-6-[(cyclopentylamino)methylene]-4-nitro-cyclohexa-2,4-dien-1-one Formula: C21H24N2O3 MolecularWeight: 352.42686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1)C2=CC(=CC(=CNC3CCCC3)C2=O)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C1=CC=CC=C1)C2=CC(=C/C(=C/NC3CCCC3)/C2=O)[N+](=O)[O-]

InChI

InChI=1S/C21H24N2O3/c1-21(2,16-8-4-3-5-9-16)19-13-18(23(25)26)12-15(20(19)24)14-22-17-10-6-7-11-17/h3-5,8-9,12-14,17,22H,6-7,10-11H2,1-2H3/b15-14-