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

Systemtic Name: methyl (2R)-2-[[(3S)-5-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-5-oxidanylidene-pentanoyl]amino]-4-methyl-pentanoate Openeye Name: methyl (2R)-2-[[(3S)-5-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-5-oxo-pentanoyl]amino]-4-methyl-pentanoate CAS Name: (2R)-2-[[(3S)-5-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-1,5-dioxopentyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[(3S)-5-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-5-oxopentanoyl]amino]-4-methylpentanoate Traditional Name: (2R)-2-[[(3S)-5-(3,4-dihydro-1H-isoquinolin-2-yl)-5-keto-3-methyl-pentanoyl]amino]-4-methyl-valeric acid methyl ester Formula: C22H32N2O4 MolecularWeight: 388.50048

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H32N2O4/c1-15(2)11-19(22(27)28-4)23-20(25)12-16(3)13-21(26)24-10-9-17-7-5-6-8-18(17)14-24/h5-8,15-16,19H,9-14H2,1-4H3,(H,23,25)/t16-,19+/m0/s1