methyl (3S)-4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanylidene-butanoate

Systemtic Name: methyl (3S)-4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanylidene-butanoate Openeye Name: methyl (3S)-3-(tert-butoxycarbonylamino)-4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxo-butanoate CAS Name: (3S)-4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-oxobutanoic acid methyl ester IUPAC Name: methyl (3S)-4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxobutanoate Traditional Name: (3S)-3-(tert-butoxycarbonylamino)-4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-keto-butyric acid methyl ester Formula: C19H26N2O5 MolecularWeight: 362.42014

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC(=O)OC)C(=O)N1CCC2=CC=CC=C2C1

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC(=O)OC)C(=O)N1CCC2=CC=CC=C2C1

InChI

InChI=1S/C19H26N2O5/c1-19(2,3)26-18(24)20-15(11-16(22)25-4)17(23)21-10-9-13-7-5-6-8-14(13)12-21/h5-8,15H,9-12H2,1-4H3,(H,20,24)/t15-/m0/s1