methyl 4-[(4-butylphenyl)sulfonylamino]-3-chloranyl-benzoate

Systemtic Name: methyl 4-[(4-butylphenyl)sulfonylamino]-3-chloranyl-benzoate Openeye Name: methyl 4-[(4-butylphenyl)sulfonylamino]-3-chloro-benzoate CAS Name: 4-[(4-butylphenyl)sulfonylamino]-3-chlorobenzoic acid methyl ester IUPAC Name: methyl 4-[(4-butylphenyl)sulfonylamino]-3-chlorobenzoate Traditional Name: 4-[(4-butylphenyl)sulfonylamino]-3-chloro-benzoic acid methyl ester Formula: C18H20ClNO4S MolecularWeight: 381.8737

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)C(=O)OC)Cl

Isomeric SMILES

CCCCC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)C(=O)OC)Cl

InChI

InChI=1S/C18H20ClNO4S/c1-3-4-5-13-6-9-15(10-7-13)25(22,23)20-17-11-8-14(12-16(17)19)18(21)24-2/h6-12,20H,3-5H2,1-2H3