2-[[2-carboxy-4-(ethylamino)phenyl]disulfanyl]-5-(ethylamino)benzoic acid

Systemtic Name: 2-[[2-carboxy-4-(ethylamino)phenyl]disulfanyl]-5-(ethylamino)benzoic acid Openeye Name: 2-[[2-carboxy-4-(ethylamino)phenyl]disulfanyl]-5-(ethylamino)benzoic acid CAS Name: 2-[[2-carboxy-4-(ethylamino)phenyl]disulfanyl]-5-(ethylamino)benzoic acid IUPAC Name: 2-[[2-carboxy-4-(ethylamino)phenyl]disulfanyl]-5-(ethylamino)benzoic acid Traditional Name: 2-[[2-carboxy-4-(ethylamino)phenyl]disulfanyl]-5-(ethylamino)benzoic acid Formula: C18H20N2O4S2 MolecularWeight: 392.4924

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=CC(=C(C=C1)SSC2=C(C=C(C=C2)NCC)C(=O)O)C(=O)O

Isomeric SMILES

CCNC1=CC(=C(C=C1)SSC2=C(C=C(C=C2)NCC)C(=O)O)C(=O)O

InChI

InChI=1S/C18H20N2O4S2/c1-3-19-11-5-7-15(13(9-11)17(21)22)25-26-16-8-6-12(20-4-2)10-14(16)18(23)24/h5-10,19-20H,3-4H2,1-2H3,(H,21,22)(H,23,24)