3-(4-azanylbutyl)-7-chloranyl-2-(5-methylthiophen-2-yl)-1H-indole-4-carboxylic acid

Systemtic Name: 3-(4-azanylbutyl)-7-chloranyl-2-(5-methylthiophen-2-yl)-1H-indole-4-carboxylic acid Openeye Name: 3-(4-aminobutyl)-7-chloro-2-(5-methyl-2-thienyl)-1H-indole-4-carboxylic acid CAS Name: 3-(4-aminobutyl)-7-chloro-2-(5-methyl-2-thiophenyl)-1H-indole-4-carboxylic acid IUPAC Name: 3-(4-aminobutyl)-7-chloro-2-(5-methylthiophen-2-yl)-1H-indole-4-carboxylic acid Traditional Name: 3-(4-aminobutyl)-7-chloro-2-(5-methyl-2-thienyl)-1H-indole-4-carboxylic acid Formula: C18H19ClN2O2S MolecularWeight: 362.87366

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C2=C(C3=C(C=CC(=C3N2)Cl)C(=O)O)CCCCN

Isomeric SMILES

CC1=CC=C(S1)C2=C(C3=C(C=CC(=C3N2)Cl)C(=O)O)CCCCN

InChI

InChI=1S/C18H19ClN2O2S/c1-10-5-8-14(24-10)16-11(4-2-3-9-20)15-12(18(22)23)6-7-13(19)17(15)21-16/h5-8,21H,2-4,9,20H2,1H3,(H,22,23)