[4-[[3-[(4-tert-butylphenyl)carbonylamino]propanoylamino]methyl]phenyl]methyl-diethyl-azanium

Systemtic Name: [4-[[3-[(4-tert-butylphenyl)carbonylamino]propanoylamino]methyl]phenyl]methyl-diethyl-azanium Openeye Name: [4-[[3-[(4-tert-butylbenzoyl)amino]propanoylamino]methyl]phenyl]methyl-diethyl-ammonium CAS Name: [4-[[[3-[[(4-tert-butylphenyl)-oxomethyl]amino]-1-oxopropyl]amino]methyl]phenyl]methyl-diethylammonium IUPAC Name: [4-[[3-[(4-tert-butylbenzoyl)amino]propanoylamino]methyl]phenyl]methyl-diethylazanium Traditional Name: [4-[[3-[(4-tert-butylbenzoyl)amino]propanoylamino]methyl]benzyl]-diethyl-ammonium Formula: C26H38N3O2+ MolecularWeight: 424.59882

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=CC=C(C=C1)CNC(=O)CCNC(=O)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC[NH+](CC)CC1=CC=C(C=C1)CNC(=O)CCNC(=O)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C26H37N3O2/c1-6-29(7-2)19-21-10-8-20(9-11-21)18-28-24(30)16-17-27-25(31)22-12-14-23(15-13-22)26(3,4)5/h8-15H,6-7,16-19H2,1-5H3,(H,27,31)(H,28,30)/p+1