[2-(4-methoxyphenyl)-6,8-dimethyl-4-oxidanylidene-chromen-3-yl] 4-chloranyl-3-nitro-benzoate

Systemtic Name: [2-(4-methoxyphenyl)-6,8-dimethyl-4-oxidanylidene-chromen-3-yl] 4-chloranyl-3-nitro-benzoate Openeye Name: [2-(4-methoxyphenyl)-6,8-dimethyl-4-oxo-chromen-3-yl] 4-chloro-3-nitro-benzoate CAS Name: 4-chloro-3-nitrobenzoic acid [2-(4-methoxyphenyl)-6,8-dimethyl-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [2-(4-methoxyphenyl)-6,8-dimethyl-4-oxochromen-3-yl] 4-chloro-3-nitrobenzoate Traditional Name: 4-chloro-3-nitro-benzoic acid [4-keto-2-(4-methoxyphenyl)-6,8-dimethyl-chromen-3-yl] ester Formula: C25H18ClNO7 MolecularWeight: 479.86592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=O)C(=C(O2)C3=CC=C(C=C3)OC)OC(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=O)C(=C(O2)C3=CC=C(C=C3)OC)OC(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-])C

InChI

InChI=1S/C25H18ClNO7/c1-13-10-14(2)22-18(11-13)21(28)24(23(33-22)15-4-7-17(32-3)8-5-15)34-25(29)16-6-9-19(26)20(12-16)27(30)31/h4-12H,1-3H3