3-[1,3-bis(oxidanylidene)benzo[e]isoindol-2-yl]-3-(3-ethoxy-4-methoxy-phenyl)propanenitrile

Systemtic Name: 3-[1,3-bis(oxidanylidene)benzo[e]isoindol-2-yl]-3-(3-ethoxy-4-methoxy-phenyl)propanenitrile Openeye Name: 3-(1,3-dioxobenzo[e]isoindol-2-yl)-3-(3-ethoxy-4-methoxy-phenyl)propanenitrile CAS Name: 3-(1,3-dioxo-2-benzo[e]isoindolyl)-3-(3-ethoxy-4-methoxyphenyl)propanenitrile IUPAC Name: 3-(1,3-dioxobenzo[e]isoindol-2-yl)-3-(3-ethoxy-4-methoxyphenyl)propanenitrile Traditional Name: 3-(1,3-diketobenz[e]isoindol-2-yl)-3-(3-ethoxy-4-methoxy-phenyl)propionitrile Formula: C24H20N2O4 MolecularWeight: 400.4266

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(CC#N)N2C(=O)C3=C(C2=O)C4=CC=CC=C4C=C3)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(CC#N)N2C(=O)C3=C(C2=O)C4=CC=CC=C4C=C3)OC

InChI

InChI=1S/C24H20N2O4/c1-3-30-21-14-16(9-11-20(21)29-2)19(12-13-25)26-23(27)18-10-8-15-6-4-5-7-17(15)22(18)24(26)28/h4-11,14,19H,3,12H2,1-2H3