N-[(E)-[2,2-dimethyl-3-(phenylmethyl)penta-3,4-dienylidene]amino]-4-methyl-2-nitro-aniline

Systemtic Name: N-[(E)-[2,2-dimethyl-3-(phenylmethyl)penta-3,4-dienylidene]amino]-4-methyl-2-nitro-aniline Openeye Name: N-[(E)-(3-benzyl-2,2-dimethyl-penta-3,4-dienylidene)amino]-4-methyl-2-nitro-aniline CAS Name: N-[(E)-[2,2-dimethyl-3-(phenylmethyl)penta-3,4-dienylidene]amino]-4-methyl-2-nitroaniline IUPAC Name: N-[(E)-(3-benzyl-2,2-dimethylpenta-3,4-dienylidene)amino]-4-methyl-2-nitroaniline Traditional Name: [(E)-(3-benzyl-2,2-dimethyl-penta-3,4-dienylidene)amino]-(4-methyl-2-nitro-phenyl)amine Formula: C21H23N3O2 MolecularWeight: 349.42622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NN=CC(C)(C)C(=C=C)CC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)N/N=C/C(C)(C)C(=C=C)CC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C21H23N3O2/c1-5-18(14-17-9-7-6-8-10-17)21(3,4)15-22-23-19-12-11-16(2)13-20(19)24(25)26/h6-13,15,23H,1,14H2,2-4H3/b22-15+