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

Systemtic Name: N-[4-[[3-azanylpropyl(cyclopropylcarbonyl)amino]methyl]phenyl]-3,4-dimethoxy-benzamide Openeye Name: N-[4-[[3-aminopropyl(cyclopropanecarbonyl)amino]methyl]phenyl]-3,4-dimethoxy-benzamide CAS Name: N-[4-[[3-aminopropyl-[cyclopropyl(oxo)methyl]amino]methyl]phenyl]-3,4-dimethoxybenzamide IUPAC Name: N-[4-[[3-aminopropyl(cyclopropanecarbonyl)amino]methyl]phenyl]-3,4-dimethoxybenzamide Traditional Name: N-[4-[[3-aminopropyl(cyclopropanecarbonyl)amino]methyl]phenyl]-3,4-dimethoxy-benzamide Formula: C23H29N3O4 MolecularWeight: 411.49406

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)CN(CCCN)C(=O)C3CC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)CN(CCCN)C(=O)C3CC3)OC

InChI

InChI=1S/C23H29N3O4/c1-29-20-11-8-18(14-21(20)30-2)22(27)25-19-9-4-16(5-10-19)15-26(13-3-12-24)23(28)17-6-7-17/h4-5,8-11,14,17H,3,6-7,12-13,15,24H2,1-2H3,(H,25,27)