5-azanyl-2-[bis[(4-bromophenyl)sulfonyl]amino]pentanoic acid

Systemtic Name: 5-azanyl-2-[bis[(4-bromophenyl)sulfonyl]amino]pentanoic acid Openeye Name: 5-amino-2-[bis[(4-bromophenyl)sulfonyl]amino]pentanoic acid CAS Name: 5-amino-2-[bis[(4-bromophenyl)sulfonyl]amino]pentanoic acid IUPAC Name: 5-amino-2-[bis[(4-bromophenyl)sulfonyl]amino]pentanoic acid Traditional Name: 5-amino-2-(dibrosylamino)valeric acid Formula: C17H18Br2N2O6S2 MolecularWeight: 570.27262

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1S(=O)(=O)N(C(CCCN)C(=O)O)S(=O)(=O)C2=CC=C(C=C2)Br)Br

Isomeric SMILES

C1=CC(=CC=C1S(=O)(=O)N(C(CCCN)C(=O)O)S(=O)(=O)C2=CC=C(C=C2)Br)Br

InChI

InChI=1S/C17H18Br2N2O6S2/c18-12-3-7-14(8-4-12)28(24,25)21(16(17(22)23)2-1-11-20)29(26,27)15-9-5-13(19)6-10-15/h3-10,16H,1-2,11,20H2,(H,22,23)