2-[1-[5-benzamido-2-[(4-cyanophenyl)carbonylamino]pentanoyl]piperidin-4-yl]oxyethanoic acid

Systemtic Name: 2-[1-[5-benzamido-2-[(4-cyanophenyl)carbonylamino]pentanoyl]piperidin-4-yl]oxyethanoic acid Openeye Name: 2-[[1-[5-benzamido-2-[(4-cyanobenzoyl)amino]pentanoyl]-4-piperidyl]oxy]acetic acid CAS Name: 2-[[1-[5-benzamido-2-[[(4-cyanophenyl)-oxomethyl]amino]-1-oxopentyl]-4-piperidinyl]oxy]acetic acid IUPAC Name: 2-[1-[5-benzamido-2-[(4-cyanobenzoyl)amino]pentanoyl]piperidin-4-yl]oxyacetic acid Traditional Name: 2-[[1-[5-benzamido-2-[(4-cyanobenzoyl)amino]pentanoyl]-4-piperidyl]oxy]acetic acid Formula: C27H30N4O6 MolecularWeight: 506.5503

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1OCC(=O)O)C(=O)C(CCCNC(=O)C2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1CN(CCC1OCC(=O)O)C(=O)C(CCCNC(=O)C2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C27H30N4O6/c28-17-19-8-10-21(11-9-19)26(35)30-23(7-4-14-29-25(34)20-5-2-1-3-6-20)27(36)31-15-12-22(13-16-31)37-18-24(32)33/h1-3,5-6,8-11,22-23H,4,7,12-16,18H2,(H,29,34)(H,30,35)(H,32,33)