methyl (2R,5S)-6,6-dimethyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanylidene-2-(phenylmethyl)heptanoate

Systemtic Name: methyl (2R,5S)-6,6-dimethyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanylidene-2-(phenylmethyl)heptanoate Openeye Name: methyl (2R,5S)-2-benzyl-5-(tert-butoxycarbonylamino)-6,6-dimethyl-4-oxo-heptanoate CAS Name: (2R,5S)-6,6-dimethyl-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-oxo-2-(phenylmethyl)heptanoic acid methyl ester IUPAC Name: methyl (2R,5S)-2-benzyl-6,6-dimethyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxoheptanoate Traditional Name: (2R,5S)-2-benzyl-5-(tert-butoxycarbonylamino)-4-keto-6,6-dimethyl-enanthic acid methyl ester Formula: C22H33NO5 MolecularWeight: 391.50112

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)CC(CC1=CC=CC=C1)C(=O)OC)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)[C@@H](C(=O)C[C@@H](CC1=CC=CC=C1)C(=O)OC)NC(=O)OC(C)(C)C

InChI

InChI=1S/C22H33NO5/c1-21(2,3)18(23-20(26)28-22(4,5)6)17(24)14-16(19(25)27-7)13-15-11-9-8-10-12-15/h8-12,16,18H,13-14H2,1-7H3,(H,23,26)/t16-,18-/m1/s1