(2-methyl-3-oxidanylidene-butan-2-yl) (1S)-6-[(3-methoxy-6-methyl-pyridin-2-yl)methoxy]-1-propan-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxylate

Systemtic Name: (2-methyl-3-oxidanylidene-butan-2-yl) (1S)-6-[(3-methoxy-6-methyl-pyridin-2-yl)methoxy]-1-propan-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxylate Openeye Name: (1,1-dimethyl-2-oxo-propyl) (1S)-1-isopropyl-6-[(3-methoxy-6-methyl-2-pyridyl)methoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylate CAS Name: (1S)-6-[(3-methoxy-6-methyl-2-pyridinyl)methoxy]-1-propan-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxylic acid (2-methyl-3-oxobutan-2-yl) ester IUPAC Name: (2-methyl-3-oxobutan-2-yl) (1S)-6-[(3-methoxy-6-methylpyridin-2-yl)methoxy]-1-propan-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxylate Traditional Name: (1S)-1-isopropyl-6-[(3-methoxy-6-methyl-2-pyridyl)methoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid (2-keto-1,1-dimethyl-propyl) ester Formula: C26H34N2O5 MolecularWeight: 454.55856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)OC)COC2=CC3=C(C=C2)C(N(CC3)C(=O)OC(C)(C)C(=O)C)C(C)C

Isomeric SMILES

CC1=NC(=C(C=C1)OC)COC2=CC3=C(C=C2)[C@@H](N(CC3)C(=O)OC(C)(C)C(=O)C)C(C)C

InChI

InChI=1S/C26H34N2O5/c1-16(2)24-21-10-9-20(32-15-22-23(31-7)11-8-17(3)27-22)14-19(21)12-13-28(24)25(30)33-26(5,6)18(4)29/h8-11,14,16,24H,12-13,15H2,1-7H3/t24-/m0/s1