2-[(4-methoxyphenyl)methyl]-4-[(3-nitro-4-propan-2-yl-phenyl)methylidene]isoquinoline-1,3-dione

Systemtic Name: 2-[(4-methoxyphenyl)methyl]-4-[(3-nitro-4-propan-2-yl-phenyl)methylidene]isoquinoline-1,3-dione Openeye Name: 4-[(4-isopropyl-3-nitro-phenyl)methylene]-2-[(4-methoxyphenyl)methyl]isoquinoline-1,3-dione CAS Name: 2-[(4-methoxyphenyl)methyl]-4-[(3-nitro-4-propan-2-ylphenyl)methylidene]isoquinoline-1,3-dione IUPAC Name: 2-[(4-methoxyphenyl)methyl]-4-[(3-nitro-4-propan-2-ylphenyl)methylidene]isoquinoline-1,3-dione Traditional Name: 4-(4-isopropyl-3-nitro-benzylidene)-2-p-anisyl-isoquinoline-1,3-quinone Formula: C27H24N2O5 MolecularWeight: 456.48986

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=C(C=C1)C=C2C3=CC=CC=C3C(=O)N(C2=O)CC4=CC=C(C=C4)OC)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=C(C=C(C=C1)C=C2C3=CC=CC=C3C(=O)N(C2=O)CC4=CC=C(C=C4)OC)[N+](=O)[O-]

InChI

InChI=1S/C27H24N2O5/c1-17(2)21-13-10-19(15-25(21)29(32)33)14-24-22-6-4-5-7-23(22)26(30)28(27(24)31)16-18-8-11-20(34-3)12-9-18/h4-15,17H,16H2,1-3H3