3-phenyl-1-propyl-isoindole-1-carboxylic acid

Systemtic Name: 3-phenyl-1-propyl-isoindole-1-carboxylic acid Openeye Name: 3-phenyl-1-propyl-isoindole-1-carboxylic acid CAS Name: 3-phenyl-1-propyl-1-isoindolecarboxylic acid IUPAC Name: 3-phenyl-1-propylisoindole-1-carboxylic acid Traditional Name: 3-phenyl-1-propyl-isoindole-1-carboxylic acid Formula: C18H17NO2 MolecularWeight: 279.33308

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(C2=CC=CC=C2C(=N1)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CCCC1(C2=CC=CC=C2C(=N1)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C18H17NO2/c1-2-12-18(17(20)21)15-11-7-6-10-14(15)16(19-18)13-8-4-3-5-9-13/h3-11H,2,12H2,1H3,(H,20,21)