3-[[(1S)-6,7-dimethoxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl]carbonyl]pyrazine-2-carboxylic acid

Systemtic Name: 3-[[(1S)-6,7-dimethoxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl]carbonyl]pyrazine-2-carboxylic acid Openeye Name: 3-[(1S)-6,7-dimethoxy-1-methyl-3,4-dihydro-1H-isoquinoline-2-carbonyl]pyrazine-2-carboxylic acid CAS Name: 3-[[(1S)-6,7-dimethoxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl]-oxomethyl]-2-pyrazinecarboxylic acid IUPAC Name: 3-[(1S)-6,7-dimethoxy-1-methyl-3,4-dihydro-1H-isoquinoline-2-carbonyl]pyrazine-2-carboxylic acid Traditional Name: 3-[(1S)-6,7-dimethoxy-1-methyl-3,4-dihydro-1H-isoquinoline-2-carbonyl]pyrazinoic acid Formula: C18H19N3O5 MolecularWeight: 357.36056

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CC(=C(C=C2CCN1C(=O)C3=NC=CN=C3C(=O)O)OC)OC

Isomeric SMILES

C[C@H]1C2=CC(=C(C=C2CCN1C(=O)C3=NC=CN=C3C(=O)O)OC)OC

InChI

InChI=1S/C18H19N3O5/c1-10-12-9-14(26-3)13(25-2)8-11(12)4-7-21(10)17(22)15-16(18(23)24)20-6-5-19-15/h5-6,8-10H,4,7H2,1-3H3,(H,23,24)/t10-/m0/s1