tert-butyl 3-[[1-[2-oxidanylidene-2-(phenylcarbamoylamino)ethyl]piperidin-3-yl]carbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-[[1-[2-oxidanylidene-2-(phenylcarbamoylamino)ethyl]piperidin-3-yl]carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 3-[[1-[2-oxo-2-(phenylcarbamoylamino)ethyl]-3-piperidyl]carbamoyl]piperidine-1-carboxylate CAS Name: 3-[[[1-[2-[[anilino(oxo)methyl]amino]-2-oxoethyl]-3-piperidinyl]amino]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[[1-[2-oxo-2-(phenylcarbamoylamino)ethyl]piperidin-3-yl]carbamoyl]piperidine-1-carboxylate Traditional Name: 3-[[1-[2-keto-2-(phenylcarbamoylamino)ethyl]-3-piperidyl]carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C25H37N5O5 MolecularWeight: 487.59178

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1)C(=O)NC2CCCN(C2)CC(=O)NC(=O)NC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC(C1)C(=O)NC2CCCN(C2)CC(=O)NC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C25H37N5O5/c1-25(2,3)35-24(34)30-14-7-9-18(15-30)22(32)26-20-12-8-13-29(16-20)17-21(31)28-23(33)27-19-10-5-4-6-11-19/h4-6,10-11,18,20H,7-9,12-17H2,1-3H3,(H,26,32)(H2,27,28,31,33)