7a-(phenylmethyl)-1,2,3,3a,4,5,6,7-octahydroisoindole-1-carboxylic acid

Systemtic Name: 7a-(phenylmethyl)-1,2,3,3a,4,5,6,7-octahydroisoindole-1-carboxylic acid Openeye Name: 7a-benzyl-1,2,3,3a,4,5,6,7-octahydroisoindole-1-carboxylic acid CAS Name: 7a-(phenylmethyl)-1,2,3,3a,4,5,6,7-octahydroisoindole-1-carboxylic acid IUPAC Name: 7a-benzyl-1,2,3,3a,4,5,6,7-octahydroisoindole-1-carboxylic acid Traditional Name: 7a-benzyl-1,2,3,3a,4,5,6,7-octahydroisoindole-1-carboxylic acid Formula: C16H21NO2 MolecularWeight: 259.34344

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C(C1)CNC2C(=O)O)CC3=CC=CC=C3

Isomeric SMILES

C1CCC2(C(C1)CNC2C(=O)O)CC3=CC=CC=C3

InChI

InChI=1S/C16H21NO2/c18-15(19)14-16(10-12-6-2-1-3-7-12)9-5-4-8-13(16)11-17-14/h1-3,6-7,13-14,17H,4-5,8-11H2,(H,18,19)