N-[3-[[3-azanylpropyl-(3-fluorophenyl)carbonyl-amino]methyl]phenyl]-3,4-dimethoxy-benzamide

Systemtic Name: N-[3-[[3-azanylpropyl-(3-fluorophenyl)carbonyl-amino]methyl]phenyl]-3,4-dimethoxy-benzamide Openeye Name: N-[3-[[3-aminopropyl-(3-fluorobenzoyl)amino]methyl]phenyl]-3,4-dimethoxy-benzamide CAS Name: N-[3-[[3-aminopropyl-[(3-fluorophenyl)-oxomethyl]amino]methyl]phenyl]-3,4-dimethoxybenzamide IUPAC Name: N-[3-[[3-aminopropyl-(3-fluorobenzoyl)amino]methyl]phenyl]-3,4-dimethoxybenzamide Traditional Name: N-[3-[[3-aminopropyl-(3-fluorobenzoyl)amino]methyl]phenyl]-3,4-dimethoxy-benzamide Formula: C26H28FN3O4 MolecularWeight: 465.516623

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC=CC(=C2)CN(CCCN)C(=O)C3=CC(=CC=C3)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC=CC(=C2)CN(CCCN)C(=O)C3=CC(=CC=C3)F)OC

InChI

InChI=1S/C26H28FN3O4/c1-33-23-11-10-19(16-24(23)34-2)25(31)29-22-9-3-6-18(14-22)17-30(13-5-12-28)26(32)20-7-4-8-21(27)15-20/h3-4,6-11,14-16H,5,12-13,17,28H2,1-2H3,(H,29,31)