6-[[3-[(4-nitrophenyl)amino]propylamino]methylidene]-4-(phenylmethyl)cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[3-[(4-nitrophenyl)amino]propylamino]methylidene]-4-(phenylmethyl)cyclohexa-2,4-dien-1-one Openeye Name: 4-benzyl-6-[[3-(4-nitroanilino)propylamino]methylene]cyclohexa-2,4-dien-1-one CAS Name: 6-[[3-(4-nitroanilino)propylamino]methylidene]-4-(phenylmethyl)-1-cyclohexa-2,4-dienone IUPAC Name: 4-benzyl-6-[[3-(4-nitroanilino)propylamino]methylidene]cyclohexa-2,4-dien-1-one Traditional Name: 4-benzyl-6-[[3-(4-nitroanilino)propylamino]methylene]cyclohexa-2,4-dien-1-one Formula: C23H23N3O3 MolecularWeight: 389.44702

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC(=CNCCCNC3=CC=C(C=C3)[N+](=O)[O-])C(=O)C=C2

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC(=CNCCCNC3=CC=C(C=C3)[N+](=O)[O-])C(=O)C=C2

InChI

InChI=1S/C23H23N3O3/c27-23-12-7-19(15-18-5-2-1-3-6-18)16-20(23)17-24-13-4-14-25-21-8-10-22(11-9-21)26(28)29/h1-3,5-12,16-17,24-25H,4,13-15H2