5-[3-(3-methylbutanoylamino)butanoylamino]-3-phenyl-1H-indole-2-carboxylic acid

Systemtic Name: 5-[3-(3-methylbutanoylamino)butanoylamino]-3-phenyl-1H-indole-2-carboxylic acid Openeye Name: 5-[3-(3-methylbutanoylamino)butanoylamino]-3-phenyl-1H-indole-2-carboxylic acid CAS Name: 5-[[3-[(3-methyl-1-oxobutyl)amino]-1-oxobutyl]amino]-3-phenyl-1H-indole-2-carboxylic acid IUPAC Name: 5-[3-(3-methylbutanoylamino)butanoylamino]-3-phenyl-1H-indole-2-carboxylic acid Traditional Name: 5-[3-(isovalerylamino)butanoylamino]-3-phenyl-1H-indole-2-carboxylic acid Formula: C24H27N3O4 MolecularWeight: 421.48888

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC(C)CC(=O)NC1=CC2=C(C=C1)NC(=C2C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC(C)CC(=O)NC(C)CC(=O)NC1=CC2=C(C=C1)NC(=C2C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C24H27N3O4/c1-14(2)11-20(28)25-15(3)12-21(29)26-17-9-10-19-18(13-17)22(23(27-19)24(30)31)16-7-5-4-6-8-16/h4-10,13-15,27H,11-12H2,1-3H3,(H,25,28)(H,26,29)(H,30,31)