2-methyl-4-[(4-phenylmethoxyphenyl)-[1-(3-pyridin-4-ylpropanoyl)piperidin-4-yl]amino]butanamide

Systemtic Name: 2-methyl-4-[(4-phenylmethoxyphenyl)-[1-(3-pyridin-4-ylpropanoyl)piperidin-4-yl]amino]butanamide Openeye Name: 4-(4-benzyloxy-N-[1-[3-(4-pyridyl)propanoyl]-4-piperidyl]anilino)-2-methyl-butanamide CAS Name: 2-methyl-4-(N-[1-(1-oxo-3-pyridin-4-ylpropyl)-4-piperidinyl]-4-phenylmethoxyanilino)butanamide IUPAC Name: 2-methyl-4-(4-phenylmethoxy-N-[1-(3-pyridin-4-ylpropanoyl)piperidin-4-yl]anilino)butanamide Traditional Name: 4-(4-benzoxy-N-[1-[3-(4-pyridyl)propanoyl]-4-piperidyl]anilino)-2-methyl-butyramide Formula: C31H38N4O3 MolecularWeight: 514.65842

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCN(C1CCN(CC1)C(=O)CCC2=CC=NC=C2)C3=CC=C(C=C3)OCC4=CC=CC=C4)C(=O)N

Isomeric SMILES

CC(CCN(C1CCN(CC1)C(=O)CCC2=CC=NC=C2)C3=CC=C(C=C3)OCC4=CC=CC=C4)C(=O)N

InChI

InChI=1S/C31H38N4O3/c1-24(31(32)37)15-22-35(27-8-10-29(11-9-27)38-23-26-5-3-2-4-6-26)28-16-20-34(21-17-28)30(36)12-7-25-13-18-33-19-14-25/h2-6,8-11,13-14,18-19,24,28H,7,12,15-17,20-23H2,1H3,(H2,32,37)