ethyl 4-[[2-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)amino]-2-oxidanylidene-ethyl]amino]benzoate

Systemtic Name: ethyl 4-[[2-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)amino]-2-oxidanylidene-ethyl]amino]benzoate Openeye Name: ethyl 4-[[2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)amino]-2-oxo-ethyl]amino]benzoate CAS Name: 4-[[2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)amino]-2-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)amino]-2-oxoethyl]amino]benzoate Traditional Name: 4-[[2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)amino]-2-keto-ethyl]amino]benzoic acid ethyl ester Formula: C19H19BrN2O5 MolecularWeight: 435.26856

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NCC(=O)NC2=CC3=C(C=C2Br)OCCO3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NCC(=O)NC2=CC3=C(C=C2Br)OCCO3

InChI

InChI=1S/C19H19BrN2O5/c1-2-25-19(24)12-3-5-13(6-4-12)21-11-18(23)22-15-10-17-16(9-14(15)20)26-7-8-27-17/h3-6,9-10,21H,2,7-8,11H2,1H3,(H,22,23)