N-[3-[[3-azanylpropyl(cyclopropylcarbonyl)amino]methyl]phenyl]cyclohexanecarboxamide

Systemtic Name: N-[3-[[3-azanylpropyl(cyclopropylcarbonyl)amino]methyl]phenyl]cyclohexanecarboxamide Openeye Name: N-[3-[[3-aminopropyl(cyclopropanecarbonyl)amino]methyl]phenyl]cyclohexanecarboxamide CAS Name: N-[3-[[3-aminopropyl-[cyclopropyl(oxo)methyl]amino]methyl]phenyl]cyclohexanecarboxamide IUPAC Name: N-[3-[[3-aminopropyl(cyclopropanecarbonyl)amino]methyl]phenyl]cyclohexanecarboxamide Traditional Name: N-[3-[[3-aminopropyl(cyclopropanecarbonyl)amino]methyl]phenyl]cyclohexanecarboxamide Formula: C21H31N3O2 MolecularWeight: 357.48974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC2=CC=CC(=C2)CN(CCCN)C(=O)C3CC3

Isomeric SMILES

C1CCC(CC1)C(=O)NC2=CC=CC(=C2)CN(CCCN)C(=O)C3CC3

InChI

InChI=1S/C21H31N3O2/c22-12-5-13-24(21(26)18-10-11-18)15-16-6-4-9-19(14-16)23-20(25)17-7-2-1-3-8-17/h4,6,9,14,17-18H,1-3,5,7-8,10-13,15,22H2,(H,23,25)