[(3S)-1-[(3-ethoxy-3-oxidanylidene-propyl)carbamoyl]piperidin-3-yl]-ethyl-(pyridin-4-ylmethyl)azanium

Systemtic Name: [(3S)-1-[(3-ethoxy-3-oxidanylidene-propyl)carbamoyl]piperidin-3-yl]-ethyl-(pyridin-4-ylmethyl)azanium Openeye Name: [(3S)-1-[(3-ethoxy-3-oxo-propyl)carbamoyl]-3-piperidyl]-ethyl-(4-pyridylmethyl)ammonium CAS Name: [(3S)-1-[[(3-ethoxy-3-oxopropyl)amino]-oxomethyl]-3-piperidinyl]-ethyl-(pyridin-4-ylmethyl)ammonium IUPAC Name: [(3S)-1-[(3-ethoxy-3-oxopropyl)carbamoyl]piperidin-3-yl]-ethyl-(pyridin-4-ylmethyl)azanium Traditional Name: [(3S)-1-[(3-ethoxy-3-keto-propyl)carbamoyl]-3-piperidyl]-ethyl-(4-pyridylmethyl)ammonium Formula: C19H31N4O3+ MolecularWeight: 363.47444

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=NC=C1)C2CCCN(C2)C(=O)NCCC(=O)OCC

Isomeric SMILES

CC[NH+](CC1=CC=NC=C1)[C@H]2CCCN(C2)C(=O)NCCC(=O)OCC

InChI

InChI=1S/C19H30N4O3/c1-3-22(14-16-7-10-20-11-8-16)17-6-5-13-23(15-17)19(25)21-12-9-18(24)26-4-2/h7-8,10-11,17H,3-6,9,12-15H2,1-2H3,(H,21,25)/p+1/t17-/m0/s1