[1-[(4-bromophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-[(3,4-diethoxyphenyl)carbonylamino]ethanoate

Systemtic Name: [1-[(4-bromophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-[(3,4-diethoxyphenyl)carbonylamino]ethanoate Openeye Name: [2-(4-bromoanilino)-1-methyl-2-oxo-ethyl] 2-[(3,4-diethoxybenzoyl)amino]acetate CAS Name: 2-[[(3,4-diethoxyphenyl)-oxomethyl]amino]acetic acid [1-(4-bromoanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-bromoanilino)-1-oxopropan-2-yl] 2-[(3,4-diethoxybenzoyl)amino]acetate Traditional Name: 2-[(3,4-diethoxybenzoyl)amino]acetic acid [2-(4-bromoanilino)-2-keto-1-methyl-ethyl] ester Formula: C22H25BrN2O6 MolecularWeight: 493.3477

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NCC(=O)OC(C)C(=O)NC2=CC=C(C=C2)Br)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NCC(=O)OC(C)C(=O)NC2=CC=C(C=C2)Br)OCC

InChI

InChI=1S/C22H25BrN2O6/c1-4-29-18-11-6-15(12-19(18)30-5-2)22(28)24-13-20(26)31-14(3)21(27)25-17-9-7-16(23)8-10-17/h6-12,14H,4-5,13H2,1-3H3,(H,24,28)(H,25,27)