dimethyl-[1-[[[4-[(propan-2-ylcarbamoylamino)methyl]phenyl]carbonylamino]methyl]cyclohexyl]azanium

Systemtic Name: dimethyl-[1-[[[4-[(propan-2-ylcarbamoylamino)methyl]phenyl]carbonylamino]methyl]cyclohexyl]azanium Openeye Name: [1-[[[4-[(isopropylcarbamoylamino)methyl]benzoyl]amino]methyl]cyclohexyl]-dimethyl-ammonium CAS Name: dimethyl-[1-[[[oxo-[4-[[[oxo-(propan-2-ylamino)methyl]amino]methyl]phenyl]methyl]amino]methyl]cyclohexyl]ammonium IUPAC Name: dimethyl-[1-[[[4-[(propan-2-ylcarbamoylamino)methyl]benzoyl]amino]methyl]cyclohexyl]azanium Traditional Name: [1-[[[4-[(isopropylcarbamoylamino)methyl]benzoyl]amino]methyl]cyclohexyl]-dimethyl-ammonium Formula: C21H35N4O2+ MolecularWeight: 375.5282

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)NCC2(CCCCC2)[NH+](C)C

Isomeric SMILES

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)NCC2(CCCCC2)[NH+](C)C

InChI

InChI=1S/C21H34N4O2/c1-16(2)24-20(27)22-14-17-8-10-18(11-9-17)19(26)23-15-21(25(3)4)12-6-5-7-13-21/h8-11,16H,5-7,12-15H2,1-4H3,(H,23,26)(H2,22,24,27)/p+1