4-[3-(3-aminophenyl)carbonylpyrrolo[2,3-b]pyridin-1-yl]butanoic acid

Systemtic Name: 4-[3-(3-aminophenyl)carbonylpyrrolo[2,3-b]pyridin-1-yl]butanoic acid Openeye Name: 4-[3-(3-aminobenzoyl)pyrrolo[2,3-b]pyridin-1-yl]butanoic acid CAS Name: 4-[3-[(3-aminophenyl)-oxomethyl]-1-pyrrolo[2,3-b]pyridinyl]butanoic acid IUPAC Name: 4-[3-(3-aminobenzoyl)pyrrolo[2,3-b]pyridin-1-yl]butanoic acid Traditional Name: 4-[3-(3-aminobenzoyl)pyrrolo[2,3-b]pyridin-1-yl]butyric acid Formula: C18H17N3O3 MolecularWeight: 323.34588

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N)C(=O)C2=CN(C3=C2C=CC=N3)CCCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)N)C(=O)C2=CN(C3=C2C=CC=N3)CCCC(=O)O

InChI

InChI=1S/C18H17N3O3/c19-13-5-1-4-12(10-13)17(24)15-11-21(9-3-7-16(22)23)18-14(15)6-2-8-20-18/h1-2,4-6,8,10-11H,3,7,9,19H2,(H,22,23)