N-[3-[4-[[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]amino]piperidin-1-yl]phenyl]-2-methoxy-benzamide

Systemtic Name: N-[3-[4-[[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]amino]piperidin-1-yl]phenyl]-2-methoxy-benzamide Openeye Name: N-[3-[4-[[(1S)-2-amino-1-benzyl-2-oxo-ethyl]amino]-1-piperidyl]phenyl]-2-methoxy-benzamide CAS Name: N-[3-[4-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-1-piperidinyl]phenyl]-2-methoxybenzamide IUPAC Name: N-[3-[4-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]piperidin-1-yl]phenyl]-2-methoxybenzamide Traditional Name: N-[3-[4-[[(1S)-2-amino-1-benzyl-2-keto-ethyl]amino]piperidino]phenyl]-2-methoxy-benzamide Formula: C28H32N4O3 MolecularWeight: 472.57868

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC2=CC=CC(=C2)N3CCC(CC3)NC(CC4=CC=CC=C4)C(=O)N

Isomeric SMILES

COC1=CC=CC=C1C(=O)NC2=CC=CC(=C2)N3CCC(CC3)N[C@@H](CC4=CC=CC=C4)C(=O)N

InChI

InChI=1S/C28H32N4O3/c1-35-26-13-6-5-12-24(26)28(34)31-22-10-7-11-23(19-22)32-16-14-21(15-17-32)30-25(27(29)33)18-20-8-3-2-4-9-20/h2-13,19,21,25,30H,14-18H2,1H3,(H2,29,33)(H,31,34)/t25-/m0/s1