N-[2-[2-(1-methylpiperidin-2-yl)ethyl]phenyl]pyridine-4-carboxamide hydrate

Systemtic Name: N-[2-[2-(1-methylpiperidin-2-yl)ethyl]phenyl]pyridine-4-carboxamide hydrate Openeye Name: N-[2-[2-(1-methyl-2-piperidyl)ethyl]phenyl]pyridine-4-carboxamide hydrate CAS Name: N-[2-[2-(1-methyl-2-piperidinyl)ethyl]phenyl]-4-pyridinecarboxamide hydrate IUPAC Name: N-[2-[2-(1-methylpiperidin-2-yl)ethyl]phenyl]pyridine-4-carboxamide hydrate Traditional Name: N-[2-[2-(1-methyl-2-piperidyl)ethyl]phenyl]isonicotinamide hydrate Formula: C20H27N3O2 MolecularWeight: 341.44728

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCCC1CCC2=CC=CC=C2NC(=O)C3=CC=NC=C3.O

Isomeric SMILES

CN1CCCCC1CCC2=CC=CC=C2NC(=O)C3=CC=NC=C3.O

InChI

InChI=1S/C20H25N3O.H2O/c1-23-15-5-4-7-18(23)10-9-16-6-2-3-8-19(16)22-20(24)17-11-13-21-14-12-17;/h2-3,6,8,11-14,18H,4-5,7,9-10,15H2,1H3,(H,22,24);1H2