[4-[[4-chloranyl-3-(2-methoxyethanoylamino)phenyl]amino]-4-oxidanylidene-butyl]azanium

Systemtic Name: [4-[[4-chloranyl-3-(2-methoxyethanoylamino)phenyl]amino]-4-oxidanylidene-butyl]azanium Openeye Name: [4-[4-chloro-3-[(2-methoxyacetyl)amino]anilino]-4-oxo-butyl]ammonium CAS Name: [4-[4-chloro-3-[(2-methoxy-1-oxoethyl)amino]anilino]-4-oxobutyl]ammonium IUPAC Name: [4-[4-chloro-3-[(2-methoxyacetyl)amino]anilino]-4-oxobutyl]azanium Traditional Name: [4-[4-chloro-3-[(2-methoxyacetyl)amino]anilino]-4-keto-butyl]ammonium Formula: C13H19ClN3O3+ MolecularWeight: 300.76126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCC(=O)NC1=C(C=CC(=C1)NC(=O)CCC[NH3+])Cl

Isomeric SMILES

COCC(=O)NC1=C(C=CC(=C1)NC(=O)CCC[NH3+])Cl

InChI

InChI=1S/C13H18ClN3O3/c1-20-8-13(19)17-11-7-9(4-5-10(11)14)16-12(18)3-2-6-15/h4-5,7H,2-3,6,8,15H2,1H3,(H,16,18)(H,17,19)/p+1