2-[2-methyl-1-(4-phenyldiazenylphenyl)carbonyl-indol-4-yl]ethanoic acid

Systemtic Name: 2-[2-methyl-1-(4-phenyldiazenylphenyl)carbonyl-indol-4-yl]ethanoic acid Openeye Name: 2-[2-methyl-1-(4-phenylazobenzoyl)indol-4-yl]acetic acid CAS Name: 2-[2-methyl-1-[oxo-(4-phenyldiazenylphenyl)methyl]-4-indolyl]acetic acid IUPAC Name: 2-[2-methyl-1-(4-phenyldiazenylbenzoyl)indol-4-yl]acetic acid Traditional Name: 2-[2-methyl-1-(4-phenylazobenzoyl)indol-4-yl]acetic acid Formula: C24H19N3O3 MolecularWeight: 397.42596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=CC=C2N1C(=O)C3=CC=C(C=C3)N=NC4=CC=CC=C4)CC(=O)O

Isomeric SMILES

CC1=CC2=C(C=CC=C2N1C(=O)C3=CC=C(C=C3)N=NC4=CC=CC=C4)CC(=O)O

InChI

InChI=1S/C24H19N3O3/c1-16-14-21-18(15-23(28)29)6-5-9-22(21)27(16)24(30)17-10-12-20(13-11-17)26-25-19-7-3-2-4-8-19/h2-14H,15H2,1H3,(H,28,29)