[4-[[[(2R)-2-(cyclohexylcarbonylamino)-3-methyl-butanoyl]amino]methyl]phenyl]methyl-diethyl-azanium

Systemtic Name: [4-[[[(2R)-2-(cyclohexylcarbonylamino)-3-methyl-butanoyl]amino]methyl]phenyl]methyl-diethyl-azanium Openeye Name: [4-[[[(2R)-2-(cyclohexanecarbonylamino)-3-methyl-butanoyl]amino]methyl]phenyl]methyl-diethyl-ammonium CAS Name: [4-[[[(2R)-2-[[cyclohexyl(oxo)methyl]amino]-3-methyl-1-oxobutyl]amino]methyl]phenyl]methyl-diethylammonium IUPAC Name: [4-[[[(2R)-2-(cyclohexanecarbonylamino)-3-methylbutanoyl]amino]methyl]phenyl]methyl-diethylazanium Traditional Name: [4-[[[(2R)-2-(cyclohexanecarbonylamino)-3-methyl-butanoyl]amino]methyl]benzyl]-diethyl-ammonium Formula: C24H40N3O2+ MolecularWeight: 402.5933

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=CC=C(C=C1)CNC(=O)C(C(C)C)NC(=O)C2CCCCC2

Isomeric SMILES

CC[NH+](CC)CC1=CC=C(C=C1)CNC(=O)[C@@H](C(C)C)NC(=O)C2CCCCC2

InChI

InChI=1S/C24H39N3O2/c1-5-27(6-2)17-20-14-12-19(13-15-20)16-25-24(29)22(18(3)4)26-23(28)21-10-8-7-9-11-21/h12-15,18,21-22H,5-11,16-17H2,1-4H3,(H,25,29)(H,26,28)/p+1/t22-/m1/s1