2-[phenyl(propanoyl)amino]-2-piperidin-3-yl-1-pyridin-4-yl-ethanolate

Systemtic Name: 2-[phenyl(propanoyl)amino]-2-piperidin-3-yl-1-pyridin-4-yl-ethanolate Openeye Name: 2-(3-piperidyl)-2-(N-propanoylanilino)-1-(4-pyridyl)ethanolate CAS Name: 2-[N-(1-oxopropyl)anilino]-2-(3-piperidinyl)-1-pyridin-4-ylethanolate IUPAC Name: 2-piperidin-3-yl-2-(N-propanoylanilino)-1-pyridin-4-ylethanolate Traditional Name: 2-(3-piperidyl)-2-(N-propionylanilino)-1-(4-pyridyl)ethanolate Formula: C21H26N3O2- MolecularWeight: 352.45004

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(C1=CC=CC=C1)C(C2CCCNC2)C(C3=CC=NC=C3)[O-]

Isomeric SMILES

CCC(=O)N(C1=CC=CC=C1)C(C2CCCNC2)C(C3=CC=NC=C3)[O-]

InChI

InChI=1S/C21H26N3O2/c1-2-19(25)24(18-8-4-3-5-9-18)20(17-7-6-12-23-15-17)21(26)16-10-13-22-14-11-16/h3-5,8-11,13-14,17,20-21,23H,2,6-7,12,15H2,1H3/q-1