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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C2=C(C3=C(C=CC(=C3N2)Cl)C(=O)O)CCCCN

Isomeric SMILES

CC1=C(SC=C1)C2=C(C3=C(C=CC(=C3N2)Cl)C(=O)O)CCCCN

InChI

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