methyl (2S,3S)-2-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)carbonylamino]-3-methyl-pentanoate

Systemtic Name: methyl (2S,3S)-2-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)carbonylamino]-3-methyl-pentanoate Openeye Name: methyl (2S,3S)-2-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)amino]-3-methyl-pentanoate CAS Name: (2S,3S)-2-[[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-oxomethyl]amino]-3-methylpentanoic acid methyl ester IUPAC Name: methyl (2S,3S)-2-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)amino]-3-methylpentanoate Traditional Name: (2S,3S)-2-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)amino]-3-methyl-valeric acid methyl ester Formula: C19H28N2O5 MolecularWeight: 364.43602

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H28N2O5/c1-6-12(2)17(18(22)26-5)20-19(23)21-8-7-13-9-15(24-3)16(25-4)10-14(13)11-21/h9-10,12,17H,6-8,11H2,1-5H3,(H,20,23)/t12-,17-/m0/s1