3-[(Z)-2-[(2,4-dimethylphenyl)amino]-1-nitro-ethenyl]-3H-2-benzofuran-1-one

Systemtic Name: 3-[(Z)-2-[(2,4-dimethylphenyl)amino]-1-nitro-ethenyl]-3H-2-benzofuran-1-one Openeye Name: 3-[(Z)-2-(2,4-dimethylanilino)-1-nitro-vinyl]-3H-isobenzofuran-1-one CAS Name: 3-[(Z)-2-(2,4-dimethylanilino)-1-nitroethenyl]-3H-isobenzofuran-1-one IUPAC Name: 3-[(Z)-2-(2,4-dimethylanilino)-1-nitroethenyl]-3H-2-benzofuran-1-one Traditional Name: 3-[(Z)-2-(2,4-dimethylanilino)-1-nitro-vinyl]phthalide Formula: C18H16N2O4 MolecularWeight: 324.33064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC=C(C2C3=CC=CC=C3C(=O)O2)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)N/C=C(/C2C3=CC=CC=C3C(=O)O2)\[N+](=O)[O-])C

InChI

InChI=1S/C18H16N2O4/c1-11-7-8-15(12(2)9-11)19-10-16(20(22)23)17-13-5-3-4-6-14(13)18(21)24-17/h3-10,17,19H,1-2H3/b16-10-