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

Systemtic Name: 2-[1-[5-azanyl-2-[(4-cyanophenyl)carbonylamino]pentanoyl]piperidin-4-yl]oxyethanoic acid Openeye Name: 2-[[1-[5-amino-2-[(4-cyanobenzoyl)amino]pentanoyl]-4-piperidyl]oxy]acetic acid CAS Name: 2-[[1-[5-amino-2-[[(4-cyanophenyl)-oxomethyl]amino]-1-oxopentyl]-4-piperidinyl]oxy]acetic acid IUPAC Name: 2-[1-[5-amino-2-[(4-cyanobenzoyl)amino]pentanoyl]piperidin-4-yl]oxyacetic acid Traditional Name: 2-[[1-[5-amino-2-[(4-cyanobenzoyl)amino]pentanoyl]-4-piperidyl]oxy]acetic acid Formula: C20H26N4O5 MolecularWeight: 402.44424

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26N4O5/c21-9-1-2-17(23-19(27)15-5-3-14(12-22)4-6-15)20(28)24-10-7-16(8-11-24)29-13-18(25)26/h3-6,16-17H,1-2,7-11,13,21H2,(H,23,27)(H,25,26)