4-(2-methyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]pyrrol-1-yl)benzoic acid

Systemtic Name: 4-(2-methyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]pyrrol-1-yl)benzoic acid Openeye Name: 4-(2-methyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]pyrrol-1-yl)benzoic acid CAS Name: 4-(2-methyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]pyrrol-1-yl)benzoic acid IUPAC Name: 4-(2-methyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]pyrrol-1-yl)benzoic acid Traditional Name: 4-(2-methyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]pyrrol-1-yl)benzoic acid Formula: C17H19NO2 MolecularWeight: 269.33826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(N1C3=CC=C(C=C3)C(=O)O)CCCCC2

Isomeric SMILES

CC1=CC2=C(N1C3=CC=C(C=C3)C(=O)O)CCCCC2

InChI

InChI=1S/C17H19NO2/c1-12-11-14-5-3-2-4-6-16(14)18(12)15-9-7-13(8-10-15)17(19)20/h7-11H,2-6H2,1H3,(H,19,20)