7-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-heptanoic acid

Systemtic Name: 7-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-heptanoic acid Openeye Name: 7-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-heptanoic acid CAS Name: 7-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methylheptanoic acid IUPAC Name: 7-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methylheptanoic acid Traditional Name: 7-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-enanthic acid Formula: C17H25NO2 MolecularWeight: 275.3859

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCN1CCC2=CC=CC=C2C1)CC(=O)O

Isomeric SMILES

CC(CCCCN1CCC2=CC=CC=C2C1)CC(=O)O

InChI

InChI=1S/C17H25NO2/c1-14(12-17(19)20)6-4-5-10-18-11-9-15-7-2-3-8-16(15)13-18/h2-3,7-8,14H,4-6,9-13H2,1H3,(H,19,20)