[(1S)-2-[(2-methoxy-5-methyl-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]-methyl-(2-phenoxyethyl)azanium

Systemtic Name: [(1S)-2-[(2-methoxy-5-methyl-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]-methyl-(2-phenoxyethyl)azanium Openeye Name: [(1S)-2-(2-methoxy-5-methyl-anilino)-2-oxo-1-phenyl-ethyl]-methyl-(2-phenoxyethyl)ammonium CAS Name: [(1S)-2-(2-methoxy-5-methylanilino)-2-oxo-1-phenylethyl]-methyl-(2-phenoxyethyl)ammonium IUPAC Name: [(1S)-2-(2-methoxy-5-methylanilino)-2-oxo-1-phenylethyl]-methyl-(2-phenoxyethyl)azanium Traditional Name: [(1S)-2-keto-2-(2-methoxy-5-methyl-anilino)-1-phenyl-ethyl]-methyl-(2-phenoxyethyl)ammonium Formula: C25H29N2O3+ MolecularWeight: 405.50936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)C(C2=CC=CC=C2)[NH+](C)CCOC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)[C@H](C2=CC=CC=C2)[NH+](C)CCOC3=CC=CC=C3

InChI

InChI=1S/C25H28N2O3/c1-19-14-15-23(29-3)22(18-19)26-25(28)24(20-10-6-4-7-11-20)27(2)16-17-30-21-12-8-5-9-13-21/h4-15,18,24H,16-17H2,1-3H3,(H,26,28)/p+1/t24-/m0/s1