ethyl 4-[(8-methyl-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)carbonylamino]benzoate

Systemtic Name: ethyl 4-[(8-methyl-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)carbonylamino]benzoate Openeye Name: ethyl 4-[(8-methyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carbonyl)amino]benzoate CAS Name: 4-[[(8-methyl-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(8-methyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carbonyl)amino]benzoate Traditional Name: 4-[(8-methyl-3,4-dihydro-2H-1,5-benzodioxepin-7-carbonyl)amino]benzoic acid ethyl ester Formula: C20H21NO5 MolecularWeight: 355.38444

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC3=C(C=C2C)OCCCO3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC3=C(C=C2C)OCCCO3

InChI

InChI=1S/C20H21NO5/c1-3-24-20(23)14-5-7-15(8-6-14)21-19(22)16-12-18-17(11-13(16)2)25-9-4-10-26-18/h5-8,11-12H,3-4,9-10H2,1-2H3,(H,21,22)