N-[[2-(5-chloranyl-1-methyl-indol-3-yl)-6-iodanyl-quinolin-4-yl]methyl]-4-methoxy-aniline

Systemtic Name: N-[[2-(5-chloranyl-1-methyl-indol-3-yl)-6-iodanyl-quinolin-4-yl]methyl]-4-methoxy-aniline Openeye Name: N-[[2-(5-chloro-1-methyl-indol-3-yl)-6-iodo-4-quinolyl]methyl]-4-methoxy-aniline CAS Name: N-[[2-(5-chloro-1-methyl-3-indolyl)-6-iodo-4-quinolinyl]methyl]-4-methoxyaniline IUPAC Name: N-[[2-(5-chloro-1-methylindol-3-yl)-6-iodoquinolin-4-yl]methyl]-4-methoxyaniline Traditional Name: [2-(5-chloro-1-methyl-indol-3-yl)-6-iodo-4-quinolyl]methyl-(4-methoxyphenyl)amine Formula: C26H21ClIN3O MolecularWeight: 553.82191

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=C1C=CC(=C2)Cl)C3=NC4=C(C=C(C=C4)I)C(=C3)CNC5=CC=C(C=C5)OC

Isomeric SMILES

CN1C=C(C2=C1C=CC(=C2)Cl)C3=NC4=C(C=C(C=C4)I)C(=C3)CNC5=CC=C(C=C5)OC

InChI

InChI=1S/C26H21ClIN3O/c1-31-15-23(22-12-17(27)3-10-26(22)31)25-11-16(21-13-18(28)4-9-24(21)30-25)14-29-19-5-7-20(32-2)8-6-19/h3-13,15,29H,14H2,1-2H3