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

Systemtic Name: methyl (2S)-2-[(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)carbonylamino]-3-methyl-butanoate Openeye Name: methyl (2S)-2-[(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinoline-2-carbonyl)amino]-3-methyl-butanoate CAS Name: (2S)-2-[[(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-oxomethyl]amino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinoline-2-carbonyl)amino]-3-methylbutanoate Traditional Name: (2S)-2-[(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinoline-2-carbonyl)amino]-3-methyl-butyric acid methyl ester Formula: C24H30N2O5 MolecularWeight: 426.5054

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NC(=O)N1CCC2=CC(=C(C=C2C1C3=CC=CC=C3)OC)OC

Isomeric SMILES

CC(C)[C@@H](C(=O)OC)NC(=O)N1CCC2=CC(=C(C=C2C1C3=CC=CC=C3)OC)OC

InChI

InChI=1S/C24H30N2O5/c1-15(2)21(23(27)31-5)25-24(28)26-12-11-17-13-19(29-3)20(30-4)14-18(17)22(26)16-9-7-6-8-10-16/h6-10,13-15,21-22H,11-12H2,1-5H3,(H,25,28)/t21-,22?/m0/s1