tert-butyl 2-[[1-[(2-ethoxy-2-oxidanylidene-ethyl)amino]-1-oxidanylidene-6-(phenylmethoxycarbonylamino)hexan-2-yl]carbamoyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 2-[[1-[(2-ethoxy-2-oxidanylidene-ethyl)amino]-1-oxidanylidene-6-(phenylmethoxycarbonylamino)hexan-2-yl]carbamoyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl 2-[[5-(benzyloxycarbonylamino)-1-[(2-ethoxy-2-oxo-ethyl)carbamoyl]pentyl]carbamoyl]pyrrolidine-1-carboxylate CAS Name: 2-[[[1-[(2-ethoxy-2-oxoethyl)amino]-1-oxo-6-(phenylmethoxycarbonylamino)hexan-2-yl]amino]-oxomethyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[1-[(2-ethoxy-2-oxoethyl)amino]-1-oxo-6-(phenylmethoxycarbonylamino)hexan-2-yl]carbamoyl]pyrrolidine-1-carboxylate Traditional Name: 2-[[5-(benzyloxycarbonylamino)-1-[(2-ethoxy-2-keto-ethyl)carbamoyl]pentyl]carbamoyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C28H42N4O8 MolecularWeight: 562.65508

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)C(CCCCNC(=O)OCC1=CC=CC=C1)NC(=O)C2CCCN2C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)CNC(=O)C(CCCCNC(=O)OCC1=CC=CC=C1)NC(=O)C2CCCN2C(=O)OC(C)(C)C

InChI

InChI=1S/C28H42N4O8/c1-5-38-23(33)18-30-24(34)21(14-9-10-16-29-26(36)39-19-20-12-7-6-8-13-20)31-25(35)22-15-11-17-32(22)27(37)40-28(2,3)4/h6-8,12-13,21-22H,5,9-11,14-19H2,1-4H3,(H,29,36)(H,30,34)(H,31,35)