1-[(1S)-2-[(3-ethanoylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]-N,N-dimethyl-piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(1S)-2-[(3-ethanoylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]-N,N-dimethyl-piperidin-1-ium-4-carboxamide Openeye Name: 1-[(1S)-2-(3-acetylanilino)-2-oxo-1-phenyl-ethyl]-N,N-dimethyl-piperidin-1-ium-4-carboxamide CAS Name: 1-[(1S)-2-(3-acetylanilino)-2-oxo-1-phenylethyl]-N,N-dimethyl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(1S)-2-(3-acetylanilino)-2-oxo-1-phenylethyl]-N,N-dimethylpiperidin-1-ium-4-carboxamide Traditional Name: 1-[(1S)-2-(3-acetylanilino)-2-keto-1-phenyl-ethyl]-N,N-dimethyl-piperidin-1-ium-4-carboxamide Formula: C24H30N3O3+ MolecularWeight: 408.5133

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)C(C2=CC=CC=C2)[NH+]3CCC(CC3)C(=O)N(C)C

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)[C@H](C2=CC=CC=C2)[NH+]3CCC(CC3)C(=O)N(C)C

InChI

InChI=1S/C24H29N3O3/c1-17(28)20-10-7-11-21(16-20)25-23(29)22(18-8-5-4-6-9-18)27-14-12-19(13-15-27)24(30)26(2)3/h4-11,16,19,22H,12-15H2,1-3H3,(H,25,29)/p+1/t22-/m0/s1