[(1R)-2-[(3-chloranyl-4-methoxy-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]-methyl-(thiophen-2-ylmethyl)azanium

Systemtic Name: [(1R)-2-[(3-chloranyl-4-methoxy-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]-methyl-(thiophen-2-ylmethyl)azanium Openeye Name: [(1R)-2-(3-chloro-4-methoxy-anilino)-2-oxo-1-phenyl-ethyl]-methyl-(2-thienylmethyl)ammonium CAS Name: [(1R)-2-(3-chloro-4-methoxyanilino)-2-oxo-1-phenylethyl]-methyl-(thiophen-2-ylmethyl)ammonium IUPAC Name: [(1R)-2-(3-chloro-4-methoxyanilino)-2-oxo-1-phenylethyl]-methyl-(thiophen-2-ylmethyl)azanium Traditional Name: [(1R)-2-(3-chloro-4-methoxy-anilino)-2-keto-1-phenyl-ethyl]-methyl-(2-thenyl)ammonium Formula: C21H22ClN2O2S+ MolecularWeight: 401.92958

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CS1)C(C2=CC=CC=C2)C(=O)NC3=CC(=C(C=C3)OC)Cl

Isomeric SMILES

C[NH+](CC1=CC=CS1)[C@H](C2=CC=CC=C2)C(=O)NC3=CC(=C(C=C3)OC)Cl

InChI

InChI=1S/C21H21ClN2O2S/c1-24(14-17-9-6-12-27-17)20(15-7-4-3-5-8-15)21(25)23-16-10-11-19(26-2)18(22)13-16/h3-13,20H,14H2,1-2H3,(H,23,25)/p+1/t20-/m1/s1