trimethyl-[(2R)-4-oxidanyl-4-oxidanylidene-2-[(4-propoxyphenyl)carbonylamino]butyl]azanium

Systemtic Name: trimethyl-[(2R)-4-oxidanyl-4-oxidanylidene-2-[(4-propoxyphenyl)carbonylamino]butyl]azanium Openeye Name: [(2R)-4-hydroxy-4-oxo-2-[(4-propoxybenzoyl)amino]butyl]-trimethyl-ammonium CAS Name: [(2R)-4-hydroxy-4-oxo-2-[[oxo-(4-propoxyphenyl)methyl]amino]butyl]-trimethylammonium IUPAC Name: [(2R)-4-hydroxy-4-oxo-2-[(4-propoxybenzoyl)amino]butyl]-trimethylazanium Traditional Name: [(2R)-4-hydroxy-4-keto-2-[(4-propoxybenzoyl)amino]butyl]-trimethyl-ammonium Formula: C17H27N2O4+ MolecularWeight: 323.40728

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)NC(CC(=O)O)C[N+](C)(C)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)N[C@H](CC(=O)O)C[N+](C)(C)C

InChI

InChI=1S/C17H26N2O4/c1-5-10-23-15-8-6-13(7-9-15)17(22)18-14(11-16(20)21)12-19(2,3)4/h6-9,14H,5,10-12H2,1-4H3,(H-,18,20,21,22)/p+1/t14-/m1/s1