2-[4-[[[3-(8-methyl-3-phenyl-cinnolin-4-yl)phenyl]amino]methyl]phenyl]ethanoic acid

Systemtic Name: 2-[4-[[[3-(8-methyl-3-phenyl-cinnolin-4-yl)phenyl]amino]methyl]phenyl]ethanoic acid Openeye Name: 2-[4-[[3-(8-methyl-3-phenyl-cinnolin-4-yl)anilino]methyl]phenyl]acetic acid CAS Name: 2-[4-[[3-(8-methyl-3-phenyl-4-cinnolinyl)anilino]methyl]phenyl]acetic acid IUPAC Name: 2-[4-[[3-(8-methyl-3-phenylcinnolin-4-yl)anilino]methyl]phenyl]acetic acid Traditional Name: 2-[4-[[3-(8-methyl-3-phenyl-cinnolin-4-yl)anilino]methyl]phenyl]acetic acid Formula: C30H25N3O2 MolecularWeight: 459.5384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C(C(=NN=C12)C3=CC=CC=C3)C4=CC(=CC=C4)NCC5=CC=C(C=C5)CC(=O)O

Isomeric SMILES

CC1=CC=CC2=C(C(=NN=C12)C3=CC=CC=C3)C4=CC(=CC=C4)NCC5=CC=C(C=C5)CC(=O)O

InChI

InChI=1S/C30H25N3O2/c1-20-7-5-12-26-28(30(33-32-29(20)26)23-8-3-2-4-9-23)24-10-6-11-25(18-24)31-19-22-15-13-21(14-16-22)17-27(34)35/h2-16,18,31H,17,19H2,1H3,(H,34,35)