2-phenoxyethanoic acid; N-(1-pyridin-4-ylpiperidin-4-yl)methanamide

Systemtic Name: 2-phenoxyethanoic acid; N-(1-pyridin-4-ylpiperidin-4-yl)methanamide Openeye Name: 2-phenoxyacetic acid; N-[1-(4-pyridyl)-4-piperidyl]formamide CAS Name: 2-phenoxyacetic acid; N-(1-pyridin-4-yl-4-piperidinyl)formamide IUPAC Name: 2-phenoxyacetic acid; N-(1-pyridin-4-ylpiperidin-4-yl)formamide Traditional Name: 2-phenoxyacetic acid; N-[1-(4-pyridyl)-4-piperidyl]formamide Formula: C19H23N3O4 MolecularWeight: 357.40362

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC=O)C2=CC=NC=C2.C1=CC=C(C=C1)OCC(=O)O

Isomeric SMILES

C1CN(CCC1NC=O)C2=CC=NC=C2.C1=CC=C(C=C1)OCC(=O)O

InChI

InChI=1S/C11H15N3O.C8H8O3/c15-9-13-10-3-7-14(8-4-10)11-1-5-12-6-2-11;9-8(10)6-11-7-4-2-1-3-5-7/h1-2,5-6,9-10H,3-4,7-8H2,(H,13,15);1-5H,6H2,(H,9,10)