2-(2-methyl-5-nitro-pyrrol-1-yl)ethyl phenothiazine-10-carboxylate

Systemtic Name: 2-(2-methyl-5-nitro-pyrrol-1-yl)ethyl phenothiazine-10-carboxylate Openeye Name: 2-(2-methyl-5-nitro-pyrrol-1-yl)ethyl phenothiazine-10-carboxylate CAS Name: 10-phenothiazinecarboxylic acid 2-(2-methyl-5-nitro-1-pyrrolyl)ethyl ester IUPAC Name: 2-(2-methyl-5-nitropyrrol-1-yl)ethyl phenothiazine-10-carboxylate Traditional Name: phenothiazine-10-carboxylic acid 2-(2-methyl-5-nitro-pyrrol-1-yl)ethyl ester Formula: C20H17N3O4S MolecularWeight: 395.43168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1CCOC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(N1CCOC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42)[N+](=O)[O-]

InChI

InChI=1S/C20H17N3O4S/c1-14-10-11-19(23(25)26)21(14)12-13-27-20(24)22-15-6-2-4-8-17(15)28-18-9-5-3-7-16(18)22/h2-11H,12-13H2,1H3