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

Systemtic Name: 3-(4-azanylbutyl)-7-chloranyl-2-(4-methylnaphthalen-1-yl)-1H-indole-4-carboxylic acid Openeye Name: 3-(4-aminobutyl)-7-chloro-2-(4-methyl-1-naphthyl)-1H-indole-4-carboxylic acid CAS Name: 3-(4-aminobutyl)-7-chloro-2-(4-methyl-1-naphthalenyl)-1H-indole-4-carboxylic acid IUPAC Name: 3-(4-aminobutyl)-7-chloro-2-(4-methylnaphthalen-1-yl)-1H-indole-4-carboxylic acid Traditional Name: 3-(4-aminobutyl)-7-chloro-2-(4-methyl-1-naphthyl)-1H-indole-4-carboxylic acid Formula: C24H23ClN2O2 MolecularWeight: 406.90462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C2=CC=CC=C12)C3=C(C4=C(C=CC(=C4N3)Cl)C(=O)O)CCCCN

Isomeric SMILES

CC1=CC=C(C2=CC=CC=C12)C3=C(C4=C(C=CC(=C4N3)Cl)C(=O)O)CCCCN

InChI

InChI=1S/C24H23ClN2O2/c1-14-9-10-17(16-7-3-2-6-15(14)16)22-18(8-4-5-13-26)21-19(24(28)29)11-12-20(25)23(21)27-22/h2-3,6-7,9-12,27H,4-5,8,13,26H2,1H3,(H,28,29)