2-[(3-bromophenyl)carbamoylamino]-4-chloranyl-5-methyl-benzenesulfonic acid

Systemtic Name: 2-[(3-bromophenyl)carbamoylamino]-4-chloranyl-5-methyl-benzenesulfonic acid Openeye Name: 2-[(3-bromophenyl)carbamoylamino]-4-chloro-5-methyl-benzenesulfonic acid CAS Name: 2-[[(3-bromoanilino)-oxomethyl]amino]-4-chloro-5-methylbenzenesulfonic acid IUPAC Name: 2-[(3-bromophenyl)carbamoylamino]-4-chloro-5-methylbenzenesulfonic acid Traditional Name: 2-[(3-bromophenyl)carbamoylamino]-4-chloro-5-methyl-besylic acid Formula: C14H12BrClN2O4S MolecularWeight: 419.67808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)NC(=O)NC2=CC(=CC=C2)Br)S(=O)(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1Cl)NC(=O)NC2=CC(=CC=C2)Br)S(=O)(=O)O

InChI

InChI=1S/C14H12BrClN2O4S/c1-8-5-13(23(20,21)22)12(7-11(8)16)18-14(19)17-10-4-2-3-9(15)6-10/h2-7H,1H3,(H2,17,18,19)(H,20,21,22)