methyl (2R)-2-[[5-(3,4-dihydro-1H-isoquinolin-2-yl)-3,3-dimethyl-5-oxidanylidene-pentanoyl]amino]-4-methyl-pentanoate

Systemtic Name: methyl (2R)-2-[[5-(3,4-dihydro-1H-isoquinolin-2-yl)-3,3-dimethyl-5-oxidanylidene-pentanoyl]amino]-4-methyl-pentanoate Openeye Name: methyl (2R)-2-[[5-(3,4-dihydro-1H-isoquinolin-2-yl)-3,3-dimethyl-5-oxo-pentanoyl]amino]-4-methyl-pentanoate CAS Name: (2R)-2-[[5-(3,4-dihydro-1H-isoquinolin-2-yl)-3,3-dimethyl-1,5-dioxopentyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[5-(3,4-dihydro-1H-isoquinolin-2-yl)-3,3-dimethyl-5-oxopentanoyl]amino]-4-methylpentanoate Traditional Name: (2R)-2-[[5-(3,4-dihydro-1H-isoquinolin-2-yl)-5-keto-3,3-dimethyl-pentanoyl]amino]-4-methyl-valeric acid methyl ester Formula: C23H34N2O4 MolecularWeight: 402.52706

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H34N2O4/c1-16(2)12-19(22(28)29-5)24-20(26)13-23(3,4)14-21(27)25-11-10-17-8-6-7-9-18(17)15-25/h6-9,16,19H,10-15H2,1-5H3,(H,24,26)/t19-/m1/s1