2-(5-methylpyrazin-2-yl)carbonyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid

Systemtic Name: 2-(5-methylpyrazin-2-yl)carbonyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Openeye Name: 2-(5-methylpyrazine-2-carbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid CAS Name: 2-[(5-methyl-2-pyrazinyl)-oxomethyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid IUPAC Name: 2-(5-methylpyrazine-2-carbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Traditional Name: 2-(5-methylpyrazinoyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Formula: C16H15N3O3 MolecularWeight: 297.3086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N=C1)C(=O)N2CC3=CC=CC=C3CC2C(=O)O

Isomeric SMILES

CC1=NC=C(N=C1)C(=O)N2CC3=CC=CC=C3CC2C(=O)O

InChI

InChI=1S/C16H15N3O3/c1-10-7-18-13(8-17-10)15(20)19-9-12-5-3-2-4-11(12)6-14(19)16(21)22/h2-5,7-8,14H,6,9H2,1H3,(H,21,22)