tert-butyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxidanylidene-5-[(phenylmethyl)amino]pentanoate

Systemtic Name: tert-butyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxidanylidene-5-[(phenylmethyl)amino]pentanoate Openeye Name: tert-butyl 5-(benzylamino)-2-(tert-butoxycarbonylamino)-5-oxo-pentanoate CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-5-oxo-5-[(phenylmethyl)amino]pentanoic acid tert-butyl ester IUPAC Name: tert-butyl 5-(benzylamino)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxopentanoate Traditional Name: 5-(benzylamino)-2-(tert-butoxycarbonylamino)-5-keto-valeric acid tert-butyl ester Formula: C21H32N2O5 MolecularWeight: 392.48918

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CCC(=O)NCC1=CC=CC=C1)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)C(CCC(=O)NCC1=CC=CC=C1)NC(=O)OC(C)(C)C

InChI

InChI=1S/C21H32N2O5/c1-20(2,3)27-18(25)16(23-19(26)28-21(4,5)6)12-13-17(24)22-14-15-10-8-7-9-11-15/h7-11,16H,12-14H2,1-6H3,(H,22,24)(H,23,26)