3-[(4-methyl-3-nitro-phenyl)amino]-1-(phenylmethyl)pyrrole-2,5-dione

Systemtic Name: 3-[(4-methyl-3-nitro-phenyl)amino]-1-(phenylmethyl)pyrrole-2,5-dione Openeye Name: 1-benzyl-3-(4-methyl-3-nitro-anilino)pyrrole-2,5-dione CAS Name: 3-(4-methyl-3-nitroanilino)-1-(phenylmethyl)pyrrole-2,5-dione IUPAC Name: 1-benzyl-3-(4-methyl-3-nitroanilino)pyrrole-2,5-dione Traditional Name: 1-benzyl-3-(4-methyl-3-nitro-anilino)-3-pyrroline-2,5-quinone Formula: C18H15N3O4 MolecularWeight: 337.3294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=CC(=O)N(C2=O)CC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=CC(=O)N(C2=O)CC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H15N3O4/c1-12-7-8-14(9-16(12)21(24)25)19-15-10-17(22)20(18(15)23)11-13-5-3-2-4-6-13/h2-10,19H,11H2,1H3