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2-[bis(2-chloroethyl)aminooxy]ethanol; pyridine; 4-sulfobenzoic acid

2-[bis(2-chloroethyl)aminooxy]ethanol; pyridine; 4-sulfobenzoic acid

Systemtic Name:2-[bis(2-chloroethyl)aminooxy]ethanol; pyridine; 4-sulfobenzoic acid
Openeye Name:2-[bis(2-chloroethyl)aminooxy]ethanol; pyridine; 4-sulfobenzoic acid
CAS Name:2-[bis(2-chloroethyl)aminooxy]ethanol; pyridine; 4-sulfobenzoic acid
IUPAC Name:2-[bis(2-chloroethyl)aminooxy]ethanol; pyridine; 4-sulfobenzoic acid
Traditional Name:2-[bis(2-chloroethyl)aminooxy]ethanol; pyridine; 4-sulfobenzoic acid
Formula: C18H24Cl2N2O7S
MolecularWeight: 483.36336
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC=C1.C1=CC(=CC=C1C(=O)O)S(=O)(=O)O.C(CCl)N(CCCl)OCCO


Isomeric SMILES

C1=CC=NC=C1.C1=CC(=CC=C1C(=O)O)S(=O)(=O)O.C(CCl)N(CCCl)OCCO


InChI

InChI=1S/C7H6O5S.C6H13Cl2NO2.C5H5N/c8-7(9)5-1-3-6(4-2-5)13(10,11)12;7-1-3-9(4-2-8)11-6-5-10;1-2-4-6-5-3-1/h1-4H,(H,8,9)(H,10,11,12);10H,1-6H2;1-5H


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