(phenylmethyl) 4-[(2-azanyl-2-oxidanylidene-ethyl)carbamoyl]-4-(2-oxidanylidenepiperidin-1-yl)piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[(2-azanyl-2-oxidanylidene-ethyl)carbamoyl]-4-(2-oxidanylidenepiperidin-1-yl)piperidine-1-carboxylate Openeye Name: benzyl 4-[(2-amino-2-oxo-ethyl)carbamoyl]-4-(2-oxo-1-piperidyl)piperidine-1-carboxylate CAS Name: 4-[[(2-amino-2-oxoethyl)amino]-oxomethyl]-4-(2-oxo-1-piperidinyl)-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[(2-amino-2-oxoethyl)carbamoyl]-4-(2-oxopiperidin-1-yl)piperidine-1-carboxylate Traditional Name: 4-[(2-amino-2-keto-ethyl)carbamoyl]-4-(2-ketopiperidino)piperidine-1-carboxylic acid benzyl ester Formula: C21H28N4O5 MolecularWeight: 416.47082

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(=O)C1)C2(CCN(CC2)C(=O)OCC3=CC=CC=C3)C(=O)NCC(=O)N

Isomeric SMILES

C1CCN(C(=O)C1)C2(CCN(CC2)C(=O)OCC3=CC=CC=C3)C(=O)NCC(=O)N

InChI

InChI=1S/C21H28N4O5/c22-17(26)14-23-19(28)21(25-11-5-4-8-18(25)27)9-12-24(13-10-21)20(29)30-15-16-6-2-1-3-7-16/h1-3,6-7H,4-5,8-15H2,(H2,22,26)(H,23,28)