(2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 3-azanyl-4-chloranyl-benzoate

Systemtic Name: (2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 3-azanyl-4-chloranyl-benzoate Openeye Name: (2-oxo-2-phenothiazin-10-yl-ethyl) 3-amino-4-chloro-benzoate CAS Name: 3-amino-4-chlorobenzoic acid [2-oxo-2-(10-phenothiazinyl)ethyl] ester IUPAC Name: (2-oxo-2-phenothiazin-10-ylethyl) 3-amino-4-chlorobenzoate Traditional Name: 3-amino-4-chloro-benzoic acid (2-keto-2-phenothiazin-10-yl-ethyl) ester Formula: C21H15ClN2O3S MolecularWeight: 410.8734

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)C(=O)COC(=O)C4=CC(=C(C=C4)Cl)N

Isomeric SMILES

C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)C(=O)COC(=O)C4=CC(=C(C=C4)Cl)N

InChI

InChI=1S/C21H15ClN2O3S/c22-14-10-9-13(11-15(14)23)21(26)27-12-20(25)24-16-5-1-3-7-18(16)28-19-8-4-2-6-17(19)24/h1-11H,12,23H2