1-[3-(2-chloranylphenothiazin-10-yl)propyl]pyrrole-2-carboxylic acid

Systemtic Name: 1-[3-(2-chloranylphenothiazin-10-yl)propyl]pyrrole-2-carboxylic acid Openeye Name: 1-[3-(2-chlorophenothiazin-10-yl)propyl]pyrrole-2-carboxylic acid CAS Name: 1-[3-(2-chloro-10-phenothiazinyl)propyl]-2-pyrrolecarboxylic acid IUPAC Name: 1-[3-(2-chlorophenothiazin-10-yl)propyl]pyrrole-2-carboxylic acid Traditional Name: 1-[3-(2-chlorophenothiazin-10-yl)propyl]pyrrole-2-carboxylic acid Formula: C20H17ClN2O2S MolecularWeight: 384.87918

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C3=C(S2)C=CC(=C3)Cl)CCCN4C=CC=C4C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)N(C3=C(S2)C=CC(=C3)Cl)CCCN4C=CC=C4C(=O)O

InChI

InChI=1S/C20H17ClN2O2S/c21-14-8-9-19-17(13-14)23(15-5-1-2-7-18(15)26-19)12-4-11-22-10-3-6-16(22)20(24)25/h1-3,5-10,13H,4,11-12H2,(H,24,25)