[3-[[(2,4-dichlorophenyl)carbamoyl-propan-2-yl-amino]methyl]phenyl] methanesulfonate

Systemtic Name: [3-[[(2,4-dichlorophenyl)carbamoyl-propan-2-yl-amino]methyl]phenyl] methanesulfonate Openeye Name: [3-[[(2,4-dichlorophenyl)carbamoyl-isopropyl-amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [3-[[[(2,4-dichloroanilino)-oxomethyl]-propan-2-ylamino]methyl]phenyl] ester IUPAC Name: [3-[[(2,4-dichlorophenyl)carbamoyl-propan-2-ylamino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [3-[[(2,4-dichlorophenyl)carbamoyl-isopropyl-amino]methyl]phenyl] ester Formula: C18H20Cl2N2O4S MolecularWeight: 431.3334

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CC(=CC=C1)OS(=O)(=O)C)C(=O)NC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CC(C)N(CC1=CC(=CC=C1)OS(=O)(=O)C)C(=O)NC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C18H20Cl2N2O4S/c1-12(2)22(18(23)21-17-8-7-14(19)10-16(17)20)11-13-5-4-6-15(9-13)26-27(3,24)25/h4-10,12H,11H2,1-3H3,(H,21,23)