3-(4-bromophenyl)-2-[[(4-bromophenyl)sulfonyl-prop-2-enyl-amino]methyl]-3-(prop-2-enylamino)propanoic acid

Systemtic Name: 3-(4-bromophenyl)-2-[[(4-bromophenyl)sulfonyl-prop-2-enyl-amino]methyl]-3-(prop-2-enylamino)propanoic acid Openeye Name: 3-(allylamino)-2-[[allyl-(4-bromophenyl)sulfonyl-amino]methyl]-3-(4-bromophenyl)propanoic acid CAS Name: 3-(4-bromophenyl)-2-[[(4-bromophenyl)sulfonyl-prop-2-enylamino]methyl]-3-(prop-2-enylamino)propanoic acid IUPAC Name: 3-(4-bromophenyl)-2-[[(4-bromophenyl)sulfonyl-prop-2-enylamino]methyl]-3-(prop-2-enylamino)propanoic acid Traditional Name: 3-(allylamino)-2-[[allyl(brosyl)amino]methyl]-3-(4-bromophenyl)propionic acid Formula: C22H24Br2N2O4S MolecularWeight: 572.30996

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(C1=CC=C(C=C1)Br)C(CN(CC=C)S(=O)(=O)C2=CC=C(C=C2)Br)C(=O)O

Isomeric SMILES

C=CCNC(C1=CC=C(C=C1)Br)C(CN(CC=C)S(=O)(=O)C2=CC=C(C=C2)Br)C(=O)O

InChI

InChI=1S/C22H24Br2N2O4S/c1-3-13-25-21(16-5-7-17(23)8-6-16)20(22(27)28)15-26(14-4-2)31(29,30)19-11-9-18(24)10-12-19/h3-12,20-21,25H,1-2,13-15H2,(H,27,28)