3-(4-azanylbutyl)-2-(3-bromophenyl)-1H-indole-5-carboxylic acid

Systemtic Name: 3-(4-azanylbutyl)-2-(3-bromophenyl)-1H-indole-5-carboxylic acid Openeye Name: 3-(4-aminobutyl)-2-(3-bromophenyl)-1H-indole-5-carboxylic acid CAS Name: 3-(4-aminobutyl)-2-(3-bromophenyl)-1H-indole-5-carboxylic acid IUPAC Name: 3-(4-aminobutyl)-2-(3-bromophenyl)-1H-indole-5-carboxylic acid Traditional Name: 3-(4-aminobutyl)-2-(3-bromophenyl)-1H-indole-5-carboxylic acid Formula: C19H19BrN2O2 MolecularWeight: 387.27036

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C2=C(C3=C(N2)C=CC(=C3)C(=O)O)CCCCN

Isomeric SMILES

C1=CC(=CC(=C1)Br)C2=C(C3=C(N2)C=CC(=C3)C(=O)O)CCCCN

InChI

InChI=1S/C19H19BrN2O2/c20-14-5-3-4-12(10-14)18-15(6-1-2-9-21)16-11-13(19(23)24)7-8-17(16)22-18/h3-5,7-8,10-11,22H,1-2,6,9,21H2,(H,23,24)