methyl 2-phenyl-2-[4-[4-(pyridin-3-ylcarbonylamino)phenyl]piperazin-1-yl]ethanoate

Systemtic Name: methyl 2-phenyl-2-[4-[4-(pyridin-3-ylcarbonylamino)phenyl]piperazin-1-yl]ethanoate Openeye Name: methyl 2-phenyl-2-[4-[4-(pyridine-3-carbonylamino)phenyl]piperazin-1-yl]acetate CAS Name: 2-[4-[4-[[oxo(3-pyridinyl)methyl]amino]phenyl]-1-piperazinyl]-2-phenylacetic acid methyl ester IUPAC Name: methyl 2-phenyl-2-[4-[4-(pyridine-3-carbonylamino)phenyl]piperazin-1-yl]acetate Traditional Name: 2-[4-(4-nicotinamidophenyl)piperazino]-2-phenyl-acetic acid methyl ester Formula: C25H26N4O3 MolecularWeight: 430.49894

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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=CN=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C25H26N4O3/c1-32-25(31)23(19-6-3-2-4-7-19)29-16-14-28(15-17-29)22-11-9-21(10-12-22)27-24(30)20-8-5-13-26-18-20/h2-13,18,23H,14-17H2,1H3,(H,27,30)