4-[1-(2,3-dihydro-1H-inden-5-yl)ethylamino]benzoic acid

Systemtic Name: 4-[1-(2,3-dihydro-1H-inden-5-yl)ethylamino]benzoic acid Openeye Name: 4-(1-indan-5-ylethylamino)benzoic acid CAS Name: 4-[1-(2,3-dihydro-1H-inden-5-yl)ethylamino]benzoic acid IUPAC Name: 4-[1-(2,3-dihydro-1H-inden-5-yl)ethylamino]benzoic acid Traditional Name: 4-(1-indan-5-ylethylamino)benzoic acid Formula: C18H19NO2 MolecularWeight: 281.34896

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(CCC2)C=C1)NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC(C1=CC2=C(CCC2)C=C1)NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C18H19NO2/c1-12(15-6-5-13-3-2-4-16(13)11-15)19-17-9-7-14(8-10-17)18(20)21/h5-12,19H,2-4H2,1H3,(H,20,21)