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

Systemtic Name: 2-[3-(4-azanylbutyl)-2-(4-methoxyquinolin-2-yl)-1H-indol-5-yl]ethanoic acid Openeye Name: 2-[3-(4-aminobutyl)-2-(4-methoxy-2-quinolyl)-1H-indol-5-yl]acetic acid CAS Name: 2-[3-(4-aminobutyl)-2-(4-methoxy-2-quinolinyl)-1H-indol-5-yl]acetic acid IUPAC Name: 2-[3-(4-aminobutyl)-2-(4-methoxyquinolin-2-yl)-1H-indol-5-yl]acetic acid Traditional Name: 2-[3-(4-aminobutyl)-2-(4-methoxy-2-quinolyl)-1H-indol-5-yl]acetic acid Formula: C24H25N3O3 MolecularWeight: 403.4736

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC2=CC=CC=C21)C3=C(C4=C(N3)C=CC(=C4)CC(=O)O)CCCCN

Isomeric SMILES

COC1=CC(=NC2=CC=CC=C21)C3=C(C4=C(N3)C=CC(=C4)CC(=O)O)CCCCN

InChI

InChI=1S/C24H25N3O3/c1-30-22-14-21(26-19-8-3-2-7-17(19)22)24-16(6-4-5-11-25)18-12-15(13-23(28)29)9-10-20(18)27-24/h2-3,7-10,12,14,27H,4-6,11,13,25H2,1H3,(H,28,29)