4-[(3-azanyl-4-ethoxy-phenyl)carbonylamino]-3-chloranyl-benzenesulfonic acid

Systemtic Name: 4-[(3-azanyl-4-ethoxy-phenyl)carbonylamino]-3-chloranyl-benzenesulfonic acid Openeye Name: 4-[(3-amino-4-ethoxy-benzoyl)amino]-3-chloro-benzenesulfonic acid CAS Name: 4-[[(3-amino-4-ethoxyphenyl)-oxomethyl]amino]-3-chlorobenzenesulfonic acid IUPAC Name: 4-[(3-amino-4-ethoxybenzoyl)amino]-3-chlorobenzenesulfonic acid Traditional Name: 4-[(3-amino-4-ethoxy-benzoyl)amino]-3-chloro-besylic acid Formula: C15H15ClN2O5S MolecularWeight: 370.808

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC2=C(C=C(C=C2)S(=O)(=O)O)Cl)N

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC2=C(C=C(C=C2)S(=O)(=O)O)Cl)N

InChI

InChI=1S/C15H15ClN2O5S/c1-2-23-14-6-3-9(7-12(14)17)15(19)18-13-5-4-10(8-11(13)16)24(20,21)22/h3-8H,2,17H2,1H3,(H,18,19)(H,20,21,22)