5-[methyl-(phenylmethyl)amino]-6-nitro-2-phenyl-isoindole-1,3-dione

Systemtic Name: 5-[methyl-(phenylmethyl)amino]-6-nitro-2-phenyl-isoindole-1,3-dione Openeye Name: 5-[benzyl(methyl)amino]-6-nitro-2-phenyl-isoindoline-1,3-dione CAS Name: 5-[methyl-(phenylmethyl)amino]-6-nitro-2-phenylisoindole-1,3-dione IUPAC Name: 5-[benzyl(methyl)amino]-6-nitro-2-phenylisoindole-1,3-dione Traditional Name: 5-[benzyl(methyl)amino]-6-nitro-2-phenyl-isoindoline-1,3-quinone Formula: C22H17N3O4 MolecularWeight: 387.38808

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C2=C(C=C3C(=C2)C(=O)N(C3=O)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC=CC=C1)C2=C(C=C3C(=C2)C(=O)N(C3=O)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H17N3O4/c1-23(14-15-8-4-2-5-9-15)19-12-17-18(13-20(19)25(28)29)22(27)24(21(17)26)16-10-6-3-7-11-16/h2-13H,14H2,1H3