(3-oxidanylidene-3-phenothiazin-10-yl-propyl) 2-chloranylpyridine-4-carboxylate

Systemtic Name: (3-oxidanylidene-3-phenothiazin-10-yl-propyl) 2-chloranylpyridine-4-carboxylate Openeye Name: (3-oxo-3-phenothiazin-10-yl-propyl) 2-chloropyridine-4-carboxylate CAS Name: 2-chloro-4-pyridinecarboxylic acid [3-oxo-3-(10-phenothiazinyl)propyl] ester IUPAC Name: (3-oxo-3-phenothiazin-10-ylpropyl) 2-chloropyridine-4-carboxylate Traditional Name: 2-chloroisonicotinic acid (3-keto-3-phenothiazin-10-yl-propyl) 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)CCOC(=O)C4=CC(=NC=C4)Cl

Isomeric SMILES

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

InChI

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