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

Systemtic Name: [(1R)-2-[(3-chloranyl-4-methyl-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]-(pyridin-2-ylmethyl)azanium Openeye Name: [(1R)-2-(3-chloro-4-methyl-anilino)-2-oxo-1-phenyl-ethyl]-(2-pyridylmethyl)ammonium CAS Name: [(1R)-2-(3-chloro-4-methylanilino)-2-oxo-1-phenylethyl]-(2-pyridinylmethyl)ammonium IUPAC Name: [(1R)-2-(3-chloro-4-methylanilino)-2-oxo-1-phenylethyl]-(pyridin-2-ylmethyl)azanium Traditional Name: [(1R)-2-(3-chloro-4-methyl-anilino)-2-keto-1-phenyl-ethyl]-(2-pyridylmethyl)ammonium Formula: C21H21ClN3O+ MolecularWeight: 366.86394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C2=CC=CC=C2)[NH2+]CC3=CC=CC=N3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)[C@@H](C2=CC=CC=C2)[NH2+]CC3=CC=CC=N3)Cl

InChI

InChI=1S/C21H20ClN3O/c1-15-10-11-17(13-19(15)22)25-21(26)20(16-7-3-2-4-8-16)24-14-18-9-5-6-12-23-18/h2-13,20,24H,14H2,1H3,(H,25,26)/p+1/t20-/m1/s1