2-[3-(4-azanylbutyl)-2-(2-methylquinolin-5-yl)-1H-indol-5-yl]ethanoic acid

Systemtic Name: 2-[3-(4-azanylbutyl)-2-(2-methylquinolin-5-yl)-1H-indol-5-yl]ethanoic acid Openeye Name: 2-[3-(4-aminobutyl)-2-(2-methyl-5-quinolyl)-1H-indol-5-yl]acetic acid CAS Name: 2-[3-(4-aminobutyl)-2-(2-methyl-5-quinolinyl)-1H-indol-5-yl]acetic acid IUPAC Name: 2-[3-(4-aminobutyl)-2-(2-methylquinolin-5-yl)-1H-indol-5-yl]acetic acid Traditional Name: 2-[3-(4-aminobutyl)-2-(2-methyl-5-quinolyl)-1H-indol-5-yl]acetic acid Formula: C24H25N3O2 MolecularWeight: 387.4742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC(=C2C=C1)C3=C(C4=C(N3)C=CC(=C4)CC(=O)O)CCCCN

Isomeric SMILES

CC1=NC2=CC=CC(=C2C=C1)C3=C(C4=C(N3)C=CC(=C4)CC(=O)O)CCCCN

InChI

InChI=1S/C24H25N3O2/c1-15-8-10-17-18(6-4-7-21(17)26-15)24-19(5-2-3-12-25)20-13-16(14-23(28)29)9-11-22(20)27-24/h4,6-11,13,27H,2-3,5,12,14,25H2,1H3,(H,28,29)