methyl (2S)-2-phenyl-2-[[1-[3-(pyridin-4-ylcarbonylamino)phenyl]piperidin-4-yl]amino]ethanoate

Systemtic Name: methyl (2S)-2-phenyl-2-[[1-[3-(pyridin-4-ylcarbonylamino)phenyl]piperidin-4-yl]amino]ethanoate Openeye Name: methyl (2S)-2-phenyl-2-[[1-[3-(pyridine-4-carbonylamino)phenyl]-4-piperidyl]amino]acetate CAS Name: (2S)-2-[[1-[3-[[oxo(pyridin-4-yl)methyl]amino]phenyl]-4-piperidinyl]amino]-2-phenylacetic acid methyl ester IUPAC Name: methyl (2S)-2-phenyl-2-[[1-[3-(pyridine-4-carbonylamino)phenyl]piperidin-4-yl]amino]acetate Traditional Name: (2S)-2-[[1-(3-isonicotinamidophenyl)-4-piperidyl]amino]-2-phenyl-acetic acid methyl ester Formula: C26H28N4O3 MolecularWeight: 444.52552

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=CC=C1)NC2CCN(CC2)C3=CC(=CC=C3)NC(=O)C4=CC=NC=C4

Isomeric SMILES

COC(=O)[C@H](C1=CC=CC=C1)NC2CCN(CC2)C3=CC(=CC=C3)NC(=O)C4=CC=NC=C4

InChI

InChI=1S/C26H28N4O3/c1-33-26(32)24(19-6-3-2-4-7-19)28-21-12-16-30(17-13-21)23-9-5-8-22(18-23)29-25(31)20-10-14-27-15-11-20/h2-11,14-15,18,21,24,28H,12-13,16-17H2,1H3,(H,29,31)/t24-/m0/s1