4-[2-(8-ethoxy-2-methyl-quinolin-5-yl)-5-iodanyl-1H-indol-3-yl]butan-1-amine

Systemtic Name: 4-[2-(8-ethoxy-2-methyl-quinolin-5-yl)-5-iodanyl-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[2-(8-ethoxy-2-methyl-5-quinolyl)-5-iodo-1H-indol-3-yl]butan-1-amine CAS Name: 4-[2-(8-ethoxy-2-methyl-5-quinolinyl)-5-iodo-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[2-(8-ethoxy-2-methylquinolin-5-yl)-5-iodo-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[2-(8-ethoxy-2-methyl-5-quinolyl)-5-iodo-1H-indol-3-yl]butylamine Formula: C24H26IN3O MolecularWeight: 499.38721

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C(=C(C=C1)C3=C(C4=C(N3)C=CC(=C4)I)CCCCN)C=CC(=N2)C

Isomeric SMILES

CCOC1=C2C(=C(C=C1)C3=C(C4=C(N3)C=CC(=C4)I)CCCCN)C=CC(=N2)C

InChI

InChI=1S/C24H26IN3O/c1-3-29-22-12-10-18(19-9-7-15(2)27-24(19)22)23-17(6-4-5-13-26)20-14-16(25)8-11-21(20)28-23/h7-12,14,28H,3-6,13,26H2,1-2H3