3-[(2,3-dihydro-1H-inden-2-ylamino)methyl]-2-phenyl-quinoline-4-carboxylic acid

Systemtic Name: 3-[(2,3-dihydro-1H-inden-2-ylamino)methyl]-2-phenyl-quinoline-4-carboxylic acid Openeye Name: 3-[(indan-2-ylamino)methyl]-2-phenyl-quinoline-4-carboxylic acid CAS Name: 3-[(2,3-dihydro-1H-inden-2-ylamino)methyl]-2-phenyl-4-quinolinecarboxylic acid IUPAC Name: 3-[(2,3-dihydro-1H-inden-2-ylamino)methyl]-2-phenylquinoline-4-carboxylic acid Traditional Name: 3-[(indan-2-ylamino)methyl]-2-phenyl-cinchoninic acid Formula: C26H22N2O2 MolecularWeight: 394.46508

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC2=CC=CC=C21)NCC3=C(C4=CC=CC=C4N=C3C5=CC=CC=C5)C(=O)O

Isomeric SMILES

C1C(CC2=CC=CC=C21)NCC3=C(C4=CC=CC=C4N=C3C5=CC=CC=C5)C(=O)O

InChI

InChI=1S/C26H22N2O2/c29-26(30)24-21-12-6-7-13-23(21)28-25(17-8-2-1-3-9-17)22(24)16-27-20-14-18-10-4-5-11-19(18)15-20/h1-13,20,27H,14-16H2,(H,29,30)