2-[2-(2-aminophenyl)carbonyl-5-(3,3-dimethylbutanoylamino)indol-1-yl]ethanoic acid

Systemtic Name: 2-[2-(2-aminophenyl)carbonyl-5-(3,3-dimethylbutanoylamino)indol-1-yl]ethanoic acid Openeye Name: 2-[2-(2-aminobenzoyl)-5-(3,3-dimethylbutanoylamino)indol-1-yl]acetic acid CAS Name: 2-[2-[(2-aminophenyl)-oxomethyl]-5-[(3,3-dimethyl-1-oxobutyl)amino]-1-indolyl]acetic acid IUPAC Name: 2-[2-(2-aminobenzoyl)-5-(3,3-dimethylbutanoylamino)indol-1-yl]acetic acid Traditional Name: 2-[2-anthraniloyl-5-(3,3-dimethylbutanoylamino)indol-1-yl]acetic acid Formula: C23H25N3O4 MolecularWeight: 407.4623

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)NC1=CC2=C(C=C1)N(C(=C2)C(=O)C3=CC=CC=C3N)CC(=O)O

Isomeric SMILES

CC(C)(C)CC(=O)NC1=CC2=C(C=C1)N(C(=C2)C(=O)C3=CC=CC=C3N)CC(=O)O

InChI

InChI=1S/C23H25N3O4/c1-23(2,3)12-20(27)25-15-8-9-18-14(10-15)11-19(26(18)13-21(28)29)22(30)16-6-4-5-7-17(16)24/h4-11H,12-13,24H2,1-3H3,(H,25,27)(H,28,29)