methyl (2S)-2-[[1-[4-(2-phenoxyethanoylamino)phenyl]piperidin-4-yl]amino]-2-phenyl-ethanoate

Systemtic Name: methyl (2S)-2-[[1-[4-(2-phenoxyethanoylamino)phenyl]piperidin-4-yl]amino]-2-phenyl-ethanoate Openeye Name: methyl (2S)-2-[[1-[4-[(2-phenoxyacetyl)amino]phenyl]-4-piperidyl]amino]-2-phenyl-acetate CAS Name: (2S)-2-[[1-[4-[(1-oxo-2-phenoxyethyl)amino]phenyl]-4-piperidinyl]amino]-2-phenylacetic acid methyl ester IUPAC Name: methyl (2S)-2-[[1-[4-[(2-phenoxyacetyl)amino]phenyl]piperidin-4-yl]amino]-2-phenylacetate Traditional Name: (2S)-2-[[1-[4-[(2-phenoxyacetyl)amino]phenyl]-4-piperidyl]amino]-2-phenyl-acetic acid methyl ester Formula: C28H31N3O4 MolecularWeight: 473.56344

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=CC=C1)NC2CCN(CC2)C3=CC=C(C=C3)NC(=O)COC4=CC=CC=C4

Isomeric SMILES

COC(=O)[C@H](C1=CC=CC=C1)NC2CCN(CC2)C3=CC=C(C=C3)NC(=O)COC4=CC=CC=C4

InChI

InChI=1S/C28H31N3O4/c1-34-28(33)27(21-8-4-2-5-9-21)30-23-16-18-31(19-17-23)24-14-12-22(13-15-24)29-26(32)20-35-25-10-6-3-7-11-25/h2-15,23,27,30H,16-20H2,1H3,(H,29,32)/t27-/m0/s1