methyl (2R)-2-[2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethoxy]ethanoylamino]-4-methyl-pentanoate

Systemtic Name: methyl (2R)-2-[2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethoxy]ethanoylamino]-4-methyl-pentanoate Openeye Name: methyl (2R)-2-[[2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethoxy]acetyl]amino]-4-methyl-pentanoate CAS Name: (2R)-2-[[2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethoxy]-1-oxoethyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethoxy]acetyl]amino]-4-methylpentanoate Traditional Name: (2R)-2-[[2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethoxy]acetyl]amino]-4-methyl-valeric acid methyl ester Formula: C20H28N2O5 MolecularWeight: 376.44672

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H28N2O5/c1-14(2)10-17(20(25)26-3)21-18(23)12-27-13-19(24)22-9-8-15-6-4-5-7-16(15)11-22/h4-7,14,17H,8-13H2,1-3H3,(H,21,23)/t17-/m1/s1