N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(4-fluorophenyl)carbonylamino]-5-methyl-1H-indole-2-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(4-fluorophenyl)carbonylamino]-5-methyl-1H-indole-2-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(4-fluorobenzoyl)amino]-5-methyl-1H-indole-2-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[[(4-fluorophenyl)-oxomethyl]amino]-5-methyl-1H-indole-2-carboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(4-fluorobenzoyl)amino]-5-methyl-1H-indole-2-carboxamide Traditional Name: 3-[(4-fluorobenzoyl)amino]-N-homoveratryl-5-methyl-1H-indole-2-carboxamide Formula: C27H26FN3O4 MolecularWeight: 475.511443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=C2NC(=O)C3=CC=C(C=C3)F)C(=O)NCCC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=C2NC(=O)C3=CC=C(C=C3)F)C(=O)NCCC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C27H26FN3O4/c1-16-4-10-21-20(14-16)24(31-26(32)18-6-8-19(28)9-7-18)25(30-21)27(33)29-13-12-17-5-11-22(34-2)23(15-17)35-3/h4-11,14-15,30H,12-13H2,1-3H3,(H,29,33)(H,31,32)