trimethyl-[(2R)-2-[(4-octylphenyl)carbamoylamino]-4-oxidanyl-4-oxidanylidene-butyl]azanium

Systemtic Name: trimethyl-[(2R)-2-[(4-octylphenyl)carbamoylamino]-4-oxidanyl-4-oxidanylidene-butyl]azanium Openeye Name: [(2R)-4-hydroxy-2-[(4-octylphenyl)carbamoylamino]-4-oxo-butyl]-trimethyl-ammonium CAS Name: [(2R)-4-hydroxy-2-[[(4-octylanilino)-oxomethyl]amino]-4-oxobutyl]-trimethylammonium IUPAC Name: [(2R)-4-hydroxy-2-[(4-octylphenyl)carbamoylamino]-4-oxobutyl]-trimethylazanium Traditional Name: [(2R)-4-hydroxy-4-keto-2-[(4-octylphenyl)carbamoylamino]butyl]-trimethyl-ammonium Formula: C22H38N3O3+ MolecularWeight: 392.55542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)NC(=O)NC(CC(=O)O)C[N+](C)(C)C

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)NC(=O)N[C@H](CC(=O)O)C[N+](C)(C)C

InChI

InChI=1S/C22H37N3O3/c1-5-6-7-8-9-10-11-18-12-14-19(15-13-18)23-22(28)24-20(16-21(26)27)17-25(2,3)4/h12-15,20H,5-11,16-17H2,1-4H3,(H2-,23,24,26,27,28)/p+1/t20-/m1/s1