[(1R)-2-[(2-methoxy-5-methyl-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]-methyl-[(2-pyrrolidin-1-ylphenyl)methyl]azanium

Systemtic Name: [(1R)-2-[(2-methoxy-5-methyl-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]-methyl-[(2-pyrrolidin-1-ylphenyl)methyl]azanium Openeye Name: [(1R)-2-(2-methoxy-5-methyl-anilino)-2-oxo-1-phenyl-ethyl]-methyl-[(2-pyrrolidin-1-ylphenyl)methyl]ammonium CAS Name: [(1R)-2-(2-methoxy-5-methylanilino)-2-oxo-1-phenylethyl]-methyl-[[2-(1-pyrrolidinyl)phenyl]methyl]ammonium IUPAC Name: [(1R)-2-(2-methoxy-5-methylanilino)-2-oxo-1-phenylethyl]-methyl-[(2-pyrrolidin-1-ylphenyl)methyl]azanium Traditional Name: [(1R)-2-keto-2-(2-methoxy-5-methyl-anilino)-1-phenyl-ethyl]-methyl-(2-pyrrolidinobenzyl)ammonium Formula: C28H34N3O2+ MolecularWeight: 444.58846

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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)CC3=CC=CC=C3N4CCCC4

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)[C@@H](C2=CC=CC=C2)[NH+](C)CC3=CC=CC=C3N4CCCC4

InChI

InChI=1S/C28H33N3O2/c1-21-15-16-26(33-3)24(19-21)29-28(32)27(22-11-5-4-6-12-22)30(2)20-23-13-7-8-14-25(23)31-17-9-10-18-31/h4-8,11-16,19,27H,9-10,17-18,20H2,1-3H3,(H,29,32)/p+1/t27-/m1/s1