3-[(5-methyl-2-nitro-phenyl)methoxy]-3-phenyl-2-(phenylmethyl)isoindol-1-one

Systemtic Name: 3-[(5-methyl-2-nitro-phenyl)methoxy]-3-phenyl-2-(phenylmethyl)isoindol-1-one Openeye Name: 2-benzyl-3-[(5-methyl-2-nitro-phenyl)methoxy]-3-phenyl-isoindolin-1-one CAS Name: 3-[(5-methyl-2-nitrophenyl)methoxy]-3-phenyl-2-(phenylmethyl)-1-isoindolone IUPAC Name: 2-benzyl-3-[(5-methyl-2-nitrophenyl)methoxy]-3-phenylisoindol-1-one Traditional Name: 2-benzyl-3-(5-methyl-2-nitro-benzyl)oxy-3-phenyl-isoindolin-1-one Formula: C29H24N2O4 MolecularWeight: 464.51186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)[N+](=O)[O-])COC2(C3=CC=CC=C3C(=O)N2CC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC(=C(C=C1)[N+](=O)[O-])COC2(C3=CC=CC=C3C(=O)N2CC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H24N2O4/c1-21-16-17-27(31(33)34)23(18-21)20-35-29(24-12-6-3-7-13-24)26-15-9-8-14-25(26)28(32)30(29)19-22-10-4-2-5-11-22/h2-18H,19-20H2,1H3