1-[(1S)-2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(1S)-2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(1S)-2-(cyclopropylamino)-2-oxo-1-phenyl-ethyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[(1S)-2-(cyclopropylamino)-2-oxo-1-phenylethyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(1S)-2-(cyclopropylamino)-2-oxo-1-phenylethyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[(1S)-2-(cyclopropylamino)-2-keto-1-phenyl-ethyl]piperidin-1-ium-4-carboxamide Formula: C17H24N3O2+ MolecularWeight: 302.39136

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C(C2=CC=CC=C2)[NH+]3CCC(CC3)C(=O)N

Isomeric SMILES

C1CC1NC(=O)[C@H](C2=CC=CC=C2)[NH+]3CCC(CC3)C(=O)N

InChI

InChI=1S/C17H23N3O2/c18-16(21)13-8-10-20(11-9-13)15(12-4-2-1-3-5-12)17(22)19-14-6-7-14/h1-5,13-15H,6-11H2,(H2,18,21)(H,19,22)/p+1/t15-/m0/s1