5-[(2-methylimidazol-1-yl)methyl]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid

Systemtic Name: 5-[(2-methylimidazol-1-yl)methyl]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid Openeye Name: 5-[(2-methylimidazol-1-yl)methyl]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid CAS Name: 5-[(2-methyl-1-imidazolyl)methyl]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid IUPAC Name: 5-[(2-methylimidazol-1-yl)methyl]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid Traditional Name: 5-[(2-methylimidazol-1-yl)methyl]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid Formula: C15H17N3O2 MolecularWeight: 271.31438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CN1CC2=CC=CC3=C2CCN(C3)C(=O)O

Isomeric SMILES

CC1=NC=CN1CC2=CC=CC3=C2CCN(C3)C(=O)O

InChI

InChI=1S/C15H17N3O2/c1-11-16-6-8-17(11)9-12-3-2-4-13-10-18(15(19)20)7-5-14(12)13/h2-4,6,8H,5,7,9-10H2,1H3,(H,19,20)