N-[3-methoxy-1-(4-pyridin-3-yloxybutyl)piperidin-4-yl]benzamide hydrate

Systemtic Name: N-[3-methoxy-1-(4-pyridin-3-yloxybutyl)piperidin-4-yl]benzamide hydrate Openeye Name: N-[3-methoxy-1-[4-(3-pyridyloxy)butyl]-4-piperidyl]benzamide hydrate CAS Name: N-[3-methoxy-1-[4-(3-pyridinyloxy)butyl]-4-piperidinyl]benzamide hydrate IUPAC Name: N-[3-methoxy-1-(4-pyridin-3-yloxybutyl)piperidin-4-yl]benzamide hydrate Traditional Name: N-[3-methoxy-1-[4-(3-pyridyloxy)butyl]-4-piperidyl]benzamide hydrate Formula: C22H31N3O4 MolecularWeight: 401.49924

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Descriptors Computed from Structure

Canonical SMILES:

COC1CN(CCC1NC(=O)C2=CC=CC=C2)CCCCOC3=CN=CC=C3.O

Isomeric SMILES

COC1CN(CCC1NC(=O)C2=CC=CC=C2)CCCCOC3=CN=CC=C3.O

InChI

InChI=1S/C22H29N3O3.H2O/c1-27-21-17-25(13-5-6-15-28-19-10-7-12-23-16-19)14-11-20(21)24-22(26)18-8-3-2-4-9-18;/h2-4,7-10,12,16,20-21H,5-6,11,13-15,17H2,1H3,(H,24,26);1H2