[phenylcarbonyl-(phenylmethyl)amino] 2-(4-pyridin-4-ylpiperazin-1-yl)propanoate

Systemtic Name: [phenylcarbonyl-(phenylmethyl)amino] 2-(4-pyridin-4-ylpiperazin-1-yl)propanoate Openeye Name: [benzoyl(benzyl)amino] 2-[4-(4-pyridyl)piperazin-1-yl]propanoate CAS Name: 2-(4-pyridin-4-yl-1-piperazinyl)propanoic acid [benzoyl-(phenylmethyl)amino] ester IUPAC Name: [benzoyl(benzyl)amino] 2-(4-pyridin-4-ylpiperazin-1-yl)propanoate Traditional Name: 2-[4-(4-pyridyl)piperazino]propionic acid [benzoyl(benzyl)amino] ester Formula: C26H28N4O3 MolecularWeight: 444.52552

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)ON(CC1=CC=CC=C1)C(=O)C2=CC=CC=C2)N3CCN(CC3)C4=CC=NC=C4

Isomeric SMILES

CC(C(=O)ON(CC1=CC=CC=C1)C(=O)C2=CC=CC=C2)N3CCN(CC3)C4=CC=NC=C4

InChI

InChI=1S/C26H28N4O3/c1-21(28-16-18-29(19-17-28)24-12-14-27-15-13-24)26(32)33-30(20-22-8-4-2-5-9-22)25(31)23-10-6-3-7-11-23/h2-15,21H,16-20H2,1H3