ethyl 1-[(4-cyanophenyl)methyl-[(2-methylpropan-2-yl)oxycarbonylamino]carbamoyl]piperidine-2-carboxylate

Systemtic Name: ethyl 1-[(4-cyanophenyl)methyl-[(2-methylpropan-2-yl)oxycarbonylamino]carbamoyl]piperidine-2-carboxylate Openeye Name: ethyl 1-[(tert-butoxycarbonylamino)-[(4-cyanophenyl)methyl]carbamoyl]piperidine-2-carboxylate CAS Name: 1-[[(4-cyanophenyl)methyl-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]amino]-oxomethyl]-2-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(4-cyanophenyl)methyl-[(2-methylpropan-2-yl)oxycarbonylamino]carbamoyl]piperidine-2-carboxylate Traditional Name: 1-[(tert-butoxycarbonylamino)-(4-cyanobenzyl)carbamoyl]pipecolinic acid ethyl ester Formula: C22H30N4O5 MolecularWeight: 430.4974

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCCN1C(=O)N(CC2=CC=C(C=C2)C#N)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C1CCCCN1C(=O)N(CC2=CC=C(C=C2)C#N)NC(=O)OC(C)(C)C

InChI

InChI=1S/C22H30N4O5/c1-5-30-19(27)18-8-6-7-13-25(18)21(29)26(24-20(28)31-22(2,3)4)15-17-11-9-16(14-23)10-12-17/h9-12,18H,5-8,13,15H2,1-4H3,(H,24,28)