2-[[(3S)-1-[(4-chlorophenyl)methyl]-6-oxidanylidene-piperidin-3-yl]carbonylamino]ethyl-diethyl-azanium

Systemtic Name: 2-[[(3S)-1-[(4-chlorophenyl)methyl]-6-oxidanylidene-piperidin-3-yl]carbonylamino]ethyl-diethyl-azanium Openeye Name: 2-[[(3S)-1-[(4-chlorophenyl)methyl]-6-oxo-piperidine-3-carbonyl]amino]ethyl-diethyl-ammonium CAS Name: 2-[[[(3S)-1-[(4-chlorophenyl)methyl]-6-oxo-3-piperidinyl]-oxomethyl]amino]ethyl-diethylammonium IUPAC Name: 2-[[(3S)-1-[(4-chlorophenyl)methyl]-6-oxopiperidine-3-carbonyl]amino]ethyl-diethylazanium Traditional Name: 2-[[(3S)-1-(4-chlorobenzyl)-6-keto-nipecotoyl]amino]ethyl-diethyl-ammonium Formula: C19H29ClN3O2+ MolecularWeight: 366.90546

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC(=O)C1CCC(=O)N(C1)CC2=CC=C(C=C2)Cl

Isomeric SMILES

CC[NH+](CC)CCNC(=O)[C@H]1CCC(=O)N(C1)CC2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H28ClN3O2/c1-3-22(4-2)12-11-21-19(25)16-7-10-18(24)23(14-16)13-15-5-8-17(20)9-6-15/h5-6,8-9,16H,3-4,7,10-14H2,1-2H3,(H,21,25)/p+1/t16-/m0/s1