3-(3-azanylpropyl)-5-[(3-bromophenyl)carbamoyl]-1H-indole-2-carboxylic acid

Systemtic Name: 3-(3-azanylpropyl)-5-[(3-bromophenyl)carbamoyl]-1H-indole-2-carboxylic acid Openeye Name: 3-(3-aminopropyl)-5-[(3-bromophenyl)carbamoyl]-1H-indole-2-carboxylic acid CAS Name: 3-(3-aminopropyl)-5-[(3-bromoanilino)-oxomethyl]-1H-indole-2-carboxylic acid IUPAC Name: 3-(3-aminopropyl)-5-[(3-bromophenyl)carbamoyl]-1H-indole-2-carboxylic acid Traditional Name: 3-(3-aminopropyl)-5-[(3-bromophenyl)carbamoyl]-1H-indole-2-carboxylic acid Formula: C19H18BrN3O3 MolecularWeight: 416.26852

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)NC(=O)C2=CC3=C(C=C2)NC(=C3CCCN)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)Br)NC(=O)C2=CC3=C(C=C2)NC(=C3CCCN)C(=O)O

InChI

InChI=1S/C19H18BrN3O3/c20-12-3-1-4-13(10-12)22-18(24)11-6-7-16-15(9-11)14(5-2-8-21)17(23-16)19(25)26/h1,3-4,6-7,9-10,23H,2,5,8,21H2,(H,22,24)(H,25,26)