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2-[butoxycarbonyl-[4-(4-chlorophenyl)phenyl]sulfonyl-amino]butanedioic acid

2-[butoxycarbonyl-[4-(4-chlorophenyl)phenyl]sulfonyl-amino]butanedioic acid

Systemtic Name:2-[butoxycarbonyl-[4-(4-chlorophenyl)phenyl]sulfonyl-amino]butanedioic acid
Openeye Name:2-[butoxycarbonyl-[4-(4-chlorophenyl)phenyl]sulfonyl-amino]butanedioic acid
CAS Name:2-[[butoxy(oxo)methyl]-[4-(4-chlorophenyl)phenyl]sulfonylamino]butanedioic acid
IUPAC Name:2-[butoxycarbonyl-[4-(4-chlorophenyl)phenyl]sulfonylamino]butanedioic acid
Traditional Name:2-[butoxycarbonyl-[4-(4-chlorophenyl)phenyl]sulfonyl-amino]succinic acid
Formula: C21H22ClNO8S
MolecularWeight: 483.91928
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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)N(C(CC(=O)O)C(=O)O)S(=O)(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)Cl


Isomeric SMILES

CCCCOC(=O)N(C(CC(=O)O)C(=O)O)S(=O)(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)Cl


InChI

InChI=1S/C21H22ClNO8S/c1-2-3-12-31-21(28)23(18(20(26)27)13-19(24)25)32(29,30)17-10-6-15(7-11-17)14-4-8-16(22)9-5-14/h4-11,18H,2-3,12-13H2,1H3,(H,24,25)(H,26,27)


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