methyl 2-phenyl-2-[4-[4-[(2-pyridin-4-ylphenyl)carbonylamino]phenyl]piperazin-1-yl]ethanoate

Systemtic Name: methyl 2-phenyl-2-[4-[4-[(2-pyridin-4-ylphenyl)carbonylamino]phenyl]piperazin-1-yl]ethanoate Openeye Name: methyl 2-phenyl-2-[4-[4-[[2-(4-pyridyl)benzoyl]amino]phenyl]piperazin-1-yl]acetate CAS Name: 2-[4-[4-[[oxo-(2-pyridin-4-ylphenyl)methyl]amino]phenyl]-1-piperazinyl]-2-phenylacetic acid methyl ester IUPAC Name: methyl 2-phenyl-2-[4-[4-[(2-pyridin-4-ylbenzoyl)amino]phenyl]piperazin-1-yl]acetate Traditional Name: 2-phenyl-2-[4-[4-[[2-(4-pyridyl)benzoyl]amino]phenyl]piperazino]acetic acid methyl ester Formula: C31H30N4O3 MolecularWeight: 506.5949

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=CC=C1)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4C5=CC=NC=C5

Isomeric SMILES

COC(=O)C(C1=CC=CC=C1)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4C5=CC=NC=C5

InChI

InChI=1S/C31H30N4O3/c1-38-31(37)29(24-7-3-2-4-8-24)35-21-19-34(20-22-35)26-13-11-25(12-14-26)33-30(36)28-10-6-5-9-27(28)23-15-17-32-18-16-23/h2-18,29H,19-22H2,1H3,(H,33,36)