[1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 2-[(4-ethoxyphenyl)sulfonylamino]benzoate

Systemtic Name: [1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 2-[(4-ethoxyphenyl)sulfonylamino]benzoate Openeye Name: (1-allophanoyl-2-methyl-propyl) 2-[(4-ethoxyphenyl)sulfonylamino]benzoate CAS Name: 2-[(4-ethoxyphenyl)sulfonylamino]benzoic acid [1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] 2-[(4-ethoxyphenyl)sulfonylamino]benzoate Traditional Name: 2-(p-phenetylsulfonylamino)benzoic acid (1-allophanoyl-2-methyl-propyl) ester Formula: C21H25N3O7S MolecularWeight: 463.5041

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2C(=O)OC(C(C)C)C(=O)NC(=O)N

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2C(=O)OC(C(C)C)C(=O)NC(=O)N

InChI

InChI=1S/C21H25N3O7S/c1-4-30-14-9-11-15(12-10-14)32(28,29)24-17-8-6-5-7-16(17)20(26)31-18(13(2)3)19(25)23-21(22)27/h5-13,18,24H,4H2,1-3H3,(H3,22,23,25,27)