[2-[[[3-(cyclopropylcarbonylamino)phenyl]methylcarbamoylamino]methyl]phenyl]methyl-dimethyl-azanium

Systemtic Name: [2-[[[3-(cyclopropylcarbonylamino)phenyl]methylcarbamoylamino]methyl]phenyl]methyl-dimethyl-azanium Openeye Name: [2-[[[3-(cyclopropanecarbonylamino)phenyl]methylcarbamoylamino]methyl]phenyl]methyl-dimethyl-ammonium CAS Name: [2-[[[[[3-[[cyclopropyl(oxo)methyl]amino]phenyl]methylamino]-oxomethyl]amino]methyl]phenyl]methyl-dimethylammonium IUPAC Name: [2-[[[3-(cyclopropanecarbonylamino)phenyl]methylcarbamoylamino]methyl]phenyl]methyl-dimethylazanium Traditional Name: [2-[[[3-(cyclopropanecarbonylamino)benzyl]carbamoylamino]methyl]benzyl]-dimethyl-ammonium Formula: C22H29N4O2+ MolecularWeight: 381.49126

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=CC=CC=C1CNC(=O)NCC2=CC(=CC=C2)NC(=O)C3CC3

Isomeric SMILES

C[NH+](C)CC1=CC=CC=C1CNC(=O)NCC2=CC(=CC=C2)NC(=O)C3CC3

InChI

InChI=1S/C22H28N4O2/c1-26(2)15-19-8-4-3-7-18(19)14-24-22(28)23-13-16-6-5-9-20(12-16)25-21(27)17-10-11-17/h3-9,12,17H,10-11,13-15H2,1-2H3,(H,25,27)(H2,23,24,28)/p+1