tert-butyl 4-[cyclopropyl-(2-ethoxy-2-oxidanylidene-ethyl)amino]-3-(hexanoylamino)-4-oxidanylidene-butanoate

Systemtic Name: tert-butyl 4-[cyclopropyl-(2-ethoxy-2-oxidanylidene-ethyl)amino]-3-(hexanoylamino)-4-oxidanylidene-butanoate Openeye Name: tert-butyl 4-[cyclopropyl-(2-ethoxy-2-oxo-ethyl)amino]-3-(hexanoylamino)-4-oxo-butanoate CAS Name: 4-[cyclopropyl-(2-ethoxy-2-oxoethyl)amino]-4-oxo-3-(1-oxohexylamino)butanoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[cyclopropyl-(2-ethoxy-2-oxoethyl)amino]-3-(hexanoylamino)-4-oxobutanoate Traditional Name: 3-(caproylamino)-4-[cyclopropyl-(2-ethoxy-2-keto-ethyl)amino]-4-keto-butyric acid tert-butyl ester Formula: C21H36N2O6 MolecularWeight: 412.52034

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC(CC(=O)OC(C)(C)C)C(=O)N(CC(=O)OCC)C1CC1

Isomeric SMILES

CCCCCC(=O)NC(CC(=O)OC(C)(C)C)C(=O)N(CC(=O)OCC)C1CC1

InChI

InChI=1S/C21H36N2O6/c1-6-8-9-10-17(24)22-16(13-18(25)29-21(3,4)5)20(27)23(15-11-12-15)14-19(26)28-7-2/h15-16H,6-14H2,1-5H3,(H,22,24)