tert-butyl 4-[butyl-(3-ethoxy-3-oxidanylidene-propyl)amino]-4-oxidanylidene-3-(phenylmethoxycarbonylamino)butanoate

Systemtic Name: tert-butyl 4-[butyl-(3-ethoxy-3-oxidanylidene-propyl)amino]-4-oxidanylidene-3-(phenylmethoxycarbonylamino)butanoate Openeye Name: tert-butyl 3-(benzyloxycarbonylamino)-4-[butyl-(3-ethoxy-3-oxo-propyl)amino]-4-oxo-butanoate CAS Name: 4-[butyl-(3-ethoxy-3-oxopropyl)amino]-4-oxo-3-(phenylmethoxycarbonylamino)butanoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[butyl-(3-ethoxy-3-oxopropyl)amino]-4-oxo-3-(phenylmethoxycarbonylamino)butanoate Traditional Name: 3-(benzyloxycarbonylamino)-4-[butyl-(3-ethoxy-3-keto-propyl)amino]-4-keto-butyric acid tert-butyl ester Formula: C25H38N2O7 MolecularWeight: 478.57842

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCC(=O)OCC)C(=O)C(CC(=O)OC(C)(C)C)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CCCCN(CCC(=O)OCC)C(=O)C(CC(=O)OC(C)(C)C)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C25H38N2O7/c1-6-8-15-27(16-14-21(28)32-7-2)23(30)20(17-22(29)34-25(3,4)5)26-24(31)33-18-19-12-10-9-11-13-19/h9-13,20H,6-8,14-18H2,1-5H3,(H,26,31)