2-[[4-(chloromethyl)phenyl]methyl-methyl-amino]ethyl hydrogen sulfate

Systemtic Name: 2-[[4-(chloromethyl)phenyl]methyl-methyl-amino]ethyl hydrogen sulfate Openeye Name: 2-[[4-(chloromethyl)phenyl]methyl-methyl-amino]ethyl hydrogen sulfate CAS Name: sulfuric acid 2-[[4-(chloromethyl)phenyl]methyl-methylamino]ethyl ester IUPAC Name: 2-[[4-(chloromethyl)phenyl]methyl-methylamino]ethyl hydrogen sulfate Traditional Name: sulfuric acid 2-[[4-(chloromethyl)benzyl]-methyl-amino]ethyl ester Formula: C11H16ClNO4S MolecularWeight: 293.76704

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCOS(=O)(=O)O)CC1=CC=C(C=C1)CCl

Isomeric SMILES

CN(CCOS(=O)(=O)O)CC1=CC=C(C=C1)CCl

InChI

InChI=1S/C11H16ClNO4S/c1-13(6-7-17-18(14,15)16)9-11-4-2-10(8-12)3-5-11/h2-5H,6-9H2,1H3,(H,14,15,16)