[10-(4-methoxyphenyl)carbonylphenothiazin-3-yl] benzoate

Systemtic Name: [10-(4-methoxyphenyl)carbonylphenothiazin-3-yl] benzoate Openeye Name: [10-(4-methoxybenzoyl)phenothiazin-3-yl] benzoate CAS Name: benzoic acid [10-[(4-methoxyphenyl)-oxomethyl]-3-phenothiazinyl] ester IUPAC Name: [10-(4-methoxybenzoyl)phenothiazin-3-yl] benzoate Traditional Name: benzoic acid (10-p-anisoylphenothiazin-3-yl) ester Formula: C27H19NO4S MolecularWeight: 453.50906

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)N2C3=C(C=C(C=C3)OC(=O)C4=CC=CC=C4)SC5=CC=CC=C52

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N2C3=C(C=C(C=C3)OC(=O)C4=CC=CC=C4)SC5=CC=CC=C52

InChI

InChI=1S/C27H19NO4S/c1-31-20-13-11-18(12-14-20)26(29)28-22-9-5-6-10-24(22)33-25-17-21(15-16-23(25)28)32-27(30)19-7-3-2-4-8-19/h2-17H,1H3