N-(5-chloranyl-2,4-dimethoxy-phenyl)-3-(1H-indol-3-yl)-2-(2-methoxyethyl)-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxamide

Systemtic Name: N-(5-chloranyl-2,4-dimethoxy-phenyl)-3-(1H-indol-3-yl)-2-(2-methoxyethyl)-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: N-(5-chloro-2,4-dimethoxy-phenyl)-3-(1H-indol-3-yl)-2-(2-methoxyethyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxamide CAS Name: N-(5-chloro-2,4-dimethoxyphenyl)-3-(1H-indol-3-yl)-2-(2-methoxyethyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: N-(5-chloro-2,4-dimethoxyphenyl)-3-(1H-indol-3-yl)-2-(2-methoxyethyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: N-(5-chloro-2,4-dimethoxy-phenyl)-3-(1H-indol-3-yl)-1-keto-2-(2-methoxyethyl)-3,4-dihydroisoquinoline-4-carboxamide Formula: C29H28ClN3O5 MolecularWeight: 534.00272

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(C(C2=CC=CC=C2C1=O)C(=O)NC3=CC(=C(C=C3OC)OC)Cl)C4=CNC5=CC=CC=C54

Isomeric SMILES

COCCN1C(C(C2=CC=CC=C2C1=O)C(=O)NC3=CC(=C(C=C3OC)OC)Cl)C4=CNC5=CC=CC=C54

InChI

InChI=1S/C29H28ClN3O5/c1-36-13-12-33-27(20-16-31-22-11-7-6-8-17(20)22)26(18-9-4-5-10-19(18)29(33)35)28(34)32-23-14-21(30)24(37-2)15-25(23)38-3/h4-11,14-16,26-27,31H,12-13H2,1-3H3,(H,32,34)