(phenylmethyl) (4S)-5-[(4-methoxyphenyl)methylamino]-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxidanylidene-pentanoate

Systemtic Name: (phenylmethyl) (4S)-5-[(4-methoxyphenyl)methylamino]-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxidanylidene-pentanoate Openeye Name: benzyl (4S)-4-(tert-butoxycarbonylamino)-5-[(4-methoxyphenyl)methylamino]-5-oxo-pentanoate CAS Name: (4S)-5-[(4-methoxyphenyl)methylamino]-4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-5-oxopentanoic acid (phenylmethyl) ester IUPAC Name: benzyl (4S)-5-[(4-methoxyphenyl)methylamino]-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxopentanoate Traditional Name: (4S)-4-(tert-butoxycarbonylamino)-5-keto-5-(p-anisylamino)valeric acid benzyl ester Formula: C25H32N2O6 MolecularWeight: 456.53138

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCC(=O)OCC1=CC=CC=C1)C(=O)NCC2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CCC(=O)OCC1=CC=CC=C1)C(=O)NCC2=CC=C(C=C2)OC

InChI

InChI=1S/C25H32N2O6/c1-25(2,3)33-24(30)27-21(14-15-22(28)32-17-19-8-6-5-7-9-19)23(29)26-16-18-10-12-20(31-4)13-11-18/h5-13,21H,14-17H2,1-4H3,(H,26,29)(H,27,30)/t21-/m0/s1