[2-[(4-butoxycarbonylphenyl)amino]-2-oxidanylidene-ethyl] 3-(aminocarbonylamino)benzoate

Systemtic Name: [2-[(4-butoxycarbonylphenyl)amino]-2-oxidanylidene-ethyl] 3-(aminocarbonylamino)benzoate Openeye Name: [2-(4-butoxycarbonylanilino)-2-oxo-ethyl] 3-ureidobenzoate CAS Name: 3-(carbamoylamino)benzoic acid [2-[4-[butoxy(oxo)methyl]anilino]-2-oxoethyl] ester IUPAC Name: [2-(4-butoxycarbonylanilino)-2-oxoethyl] 3-(carbamoylamino)benzoate Traditional Name: 3-ureidobenzoic acid [2-(4-butoxycarbonylanilino)-2-keto-ethyl] ester Formula: C21H23N3O6 MolecularWeight: 413.42382

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)COC(=O)C2=CC(=CC=C2)NC(=O)N

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)COC(=O)C2=CC(=CC=C2)NC(=O)N

InChI

InChI=1S/C21H23N3O6/c1-2-3-11-29-19(26)14-7-9-16(10-8-14)23-18(25)13-30-20(27)15-5-4-6-17(12-15)24-21(22)28/h4-10,12H,2-3,11,13H2,1H3,(H,23,25)(H3,22,24,28)