(3S)-6,7-dimethoxy-3-[(4-nitrophenyl)amino]-3H-2-benzofuran-1-one

Systemtic Name: (3S)-6,7-dimethoxy-3-[(4-nitrophenyl)amino]-3H-2-benzofuran-1-one Openeye Name: (3S)-6,7-dimethoxy-3-(4-nitroanilino)-3H-isobenzofuran-1-one CAS Name: (3S)-6,7-dimethoxy-3-(4-nitroanilino)-3H-isobenzofuran-1-one IUPAC Name: (3S)-6,7-dimethoxy-3-(4-nitroanilino)-3H-2-benzofuran-1-one Traditional Name: (3S)-6,7-dimethoxy-3-(4-nitroanilino)phthalide Formula: C16H14N2O6 MolecularWeight: 330.29216

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C(OC2=O)NC3=CC=C(C=C3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C2=C(C=C1)[C@H](OC2=O)NC3=CC=C(C=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C16H14N2O6/c1-22-12-8-7-11-13(14(12)23-2)16(19)24-15(11)17-9-3-5-10(6-4-9)18(20)21/h3-8,15,17H,1-2H3/t15-/m0/s1