[3-[(3-chloranyl-2-methyl-phenyl)amino]-3-oxidanylidene-propyl]-methyl-(phenylmethyl)azanium

Systemtic Name: [3-[(3-chloranyl-2-methyl-phenyl)amino]-3-oxidanylidene-propyl]-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[3-(3-chloro-2-methyl-anilino)-3-oxo-propyl]-methyl-ammonium CAS Name: [3-(3-chloro-2-methylanilino)-3-oxopropyl]-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[3-(3-chloro-2-methylanilino)-3-oxopropyl]-methylazanium Traditional Name: benzyl-[3-(3-chloro-2-methyl-anilino)-3-keto-propyl]-methyl-ammonium Formula: C18H22ClN2O+ MolecularWeight: 317.83308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)CC[NH+](C)CC2=CC=CC=C2

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)CC[NH+](C)CC2=CC=CC=C2

InChI

InChI=1S/C18H21ClN2O/c1-14-16(19)9-6-10-17(14)20-18(22)11-12-21(2)13-15-7-4-3-5-8-15/h3-10H,11-13H2,1-2H3,(H,20,22)/p+1