2-[(5S)-5-[(4-methoxycarbonylphenyl)methylcarbamoyl]-2-oxidanylidene-piperidin-1-yl]ethyl-dimethyl-azanium

Systemtic Name: 2-[(5S)-5-[(4-methoxycarbonylphenyl)methylcarbamoyl]-2-oxidanylidene-piperidin-1-yl]ethyl-dimethyl-azanium Openeye Name: 2-[(5S)-5-[(4-methoxycarbonylphenyl)methylcarbamoyl]-2-oxo-1-piperidyl]ethyl-dimethyl-ammonium CAS Name: 2-[(5S)-5-[[(4-methoxycarbonylphenyl)methylamino]-oxomethyl]-2-oxo-1-piperidinyl]ethyl-dimethylammonium IUPAC Name: 2-[(5S)-5-[(4-methoxycarbonylphenyl)methylcarbamoyl]-2-oxopiperidin-1-yl]ethyl-dimethylazanium Traditional Name: 2-[(5S)-5-[(4-carbomethoxybenzyl)carbamoyl]-2-keto-piperidino]ethyl-dimethyl-ammonium Formula: C19H28N3O4+ MolecularWeight: 362.44332

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCN1CC(CCC1=O)C(=O)NCC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

C[NH+](C)CCN1C[C@H](CCC1=O)C(=O)NCC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C19H27N3O4/c1-21(2)10-11-22-13-16(8-9-17(22)23)18(24)20-12-14-4-6-15(7-5-14)19(25)26-3/h4-7,16H,8-13H2,1-3H3,(H,20,24)/p+1/t16-/m0/s1