2-diethylaminoethyl 4-[(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)carbonylamino]benzoate hydrochloride

Systemtic Name: 2-diethylaminoethyl 4-[(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)carbonylamino]benzoate hydrochloride Openeye Name: 2-diethylaminoethyl 4-[(4-methyl-3-morpholinosulfonyl-benzoyl)amino]benzoate hydrochloride CAS Name: 4-[[[4-methyl-3-(4-morpholinylsulfonyl)phenyl]-oxomethyl]amino]benzoic acid 2-diethylaminoethyl ester hydrochloride IUPAC Name: 2-diethylaminoethyl 4-[(4-methyl-3-morpholin-4-ylsulfonylbenzoyl)amino]benzoate hydrochloride Traditional Name: 4-[(4-methyl-3-morpholinosulfonyl-benzoyl)amino]benzoic acid 2-diethylaminoethyl ester hydrochloride Formula: C25H34ClN3O6S MolecularWeight: 540.07196

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)C)S(=O)(=O)N3CCOCC3.Cl

Isomeric SMILES

CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)C)S(=O)(=O)N3CCOCC3.Cl

InChI

InChI=1S/C25H33N3O6S.ClH/c1-4-27(5-2)12-17-34-25(30)20-8-10-22(11-9-20)26-24(29)21-7-6-19(3)23(18-21)35(31,32)28-13-15-33-16-14-28;/h6-11,18H,4-5,12-17H2,1-3H3,(H,26,29);1H