3-(2-aminocarbonylpyrrolidin-1-yl)carbonyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylic acid

Systemtic Name: 3-(2-aminocarbonylpyrrolidin-1-yl)carbonyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylic acid Openeye Name: 3-(2-carbamoylpyrrolidine-1-carbonyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylic acid CAS Name: 3-[(2-carbamoyl-1-pyrrolidinyl)-oxomethyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylic acid IUPAC Name: 3-(2-carbamoylpyrrolidine-1-carbonyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylic acid Traditional Name: 3-(2-carbamoylpyrrolidine-1-carbonyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylic acid Formula: C18H23N3O6 MolecularWeight: 377.39172

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(C(CC2=C1)C(=O)N3CCCC3C(=O)N)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C2CN(C(CC2=C1)C(=O)N3CCCC3C(=O)N)C(=O)O)OC

InChI

InChI=1S/C18H23N3O6/c1-26-14-7-10-6-13(17(23)20-5-3-4-12(20)16(19)22)21(18(24)25)9-11(10)8-15(14)27-2/h7-8,12-13H,3-6,9H2,1-2H3,(H2,19,22)(H,24,25)