2-[2-[(3-methylphenyl)amino]-4-(4-nitrophenyl)-1,3-thiazol-3-ium-3-yl]ethanol

Systemtic Name: 2-[2-[(3-methylphenyl)amino]-4-(4-nitrophenyl)-1,3-thiazol-3-ium-3-yl]ethanol Openeye Name: 2-[2-(3-methylanilino)-4-(4-nitrophenyl)thiazol-3-ium-3-yl]ethanol CAS Name: 2-[2-(3-methylanilino)-4-(4-nitrophenyl)-3-thiazol-3-iumyl]ethanol IUPAC Name: 2-[2-(3-methylanilino)-4-(4-nitrophenyl)-1,3-thiazol-3-ium-3-yl]ethanol Traditional Name: 2-[2-(m-toluidino)-4-(4-nitrophenyl)thiazol-3-ium-3-yl]ethanol Formula: C18H18N3O3S+ MolecularWeight: 356.41882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=[N+](C(=CS2)C3=CC=C(C=C3)[N+](=O)[O-])CCO

Isomeric SMILES

CC1=CC(=CC=C1)NC2=[N+](C(=CS2)C3=CC=C(C=C3)[N+](=O)[O-])CCO

InChI

InChI=1S/C18H17N3O3S/c1-13-3-2-4-15(11-13)19-18-20(9-10-22)17(12-25-18)14-5-7-16(8-6-14)21(23)24/h2-8,11-12,22H,9-10H2,1H3/p+1