methyl 4-[(4-methyl-5-oxidanylidene-2,3-dihydro-1,4-benzoxazepin-7-yl)carbamoyl]benzoate

Systemtic Name: methyl 4-[(4-methyl-5-oxidanylidene-2,3-dihydro-1,4-benzoxazepin-7-yl)carbamoyl]benzoate Openeye Name: methyl 4-[(4-methyl-5-oxo-2,3-dihydro-1,4-benzoxazepin-7-yl)carbamoyl]benzoate CAS Name: 4-[[(4-methyl-5-oxo-2,3-dihydro-1,4-benzoxazepin-7-yl)amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(4-methyl-5-oxo-2,3-dihydro-1,4-benzoxazepin-7-yl)carbamoyl]benzoate Traditional Name: 4-[(5-keto-4-methyl-2,3-dihydro-1,4-benzoxazepin-7-yl)carbamoyl]benzoic acid methyl ester Formula: C19H18N2O5 MolecularWeight: 354.35662

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCOC2=C(C1=O)C=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CN1CCOC2=C(C1=O)C=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C19H18N2O5/c1-21-9-10-26-16-8-7-14(11-15(16)18(21)23)20-17(22)12-3-5-13(6-4-12)19(24)25-2/h3-8,11H,9-10H2,1-2H3,(H,20,22)