2-[1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]cyclopentyl]ethanoic acid

Systemtic Name: 2-[1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]cyclopentyl]ethanoic acid Openeye Name: 2-[1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]cyclopentyl]acetic acid CAS Name: 2-[1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]cyclopentyl]acetic acid IUPAC Name: 2-[1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]cyclopentyl]acetic acid Traditional Name: 2-[1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]cyclopentyl]acetic acid Formula: C18H23NO3 MolecularWeight: 301.38012

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(CC(=O)N2CCC3=CC=CC=C3C2)CC(=O)O

Isomeric SMILES

C1CCC(C1)(CC(=O)N2CCC3=CC=CC=C3C2)CC(=O)O

InChI

InChI=1S/C18H23NO3/c20-16(11-18(12-17(21)22)8-3-4-9-18)19-10-7-14-5-1-2-6-15(14)13-19/h1-2,5-6H,3-4,7-13H2,(H,21,22)