methyl 4-[[3,3-dimethyl-5-(2-methylpropyl)-4-oxidanylidene-2H-1,5-benzoxazepin-8-yl]carbamoyl]benzoate

Systemtic Name: methyl 4-[[3,3-dimethyl-5-(2-methylpropyl)-4-oxidanylidene-2H-1,5-benzoxazepin-8-yl]carbamoyl]benzoate Openeye Name: methyl 4-[(5-isobutyl-3,3-dimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)carbamoyl]benzoate CAS Name: 4-[[[3,3-dimethyl-5-(2-methylpropyl)-4-oxo-2H-1,5-benzoxazepin-8-yl]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[3,3-dimethyl-5-(2-methylpropyl)-4-oxo-2H-1,5-benzoxazepin-8-yl]carbamoyl]benzoate Traditional Name: 4-[(5-isobutyl-4-keto-3,3-dimethyl-2H-1,5-benzoxazepin-8-yl)carbamoyl]benzoic acid methyl ester Formula: C24H28N2O5 MolecularWeight: 424.48952

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=C(C=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=O)OC)OCC(C1=O)(C)C

Isomeric SMILES

CC(C)CN1C2=C(C=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=O)OC)OCC(C1=O)(C)C

InChI

InChI=1S/C24H28N2O5/c1-15(2)13-26-19-11-10-18(12-20(19)31-14-24(3,4)23(26)29)25-21(27)16-6-8-17(9-7-16)22(28)30-5/h6-12,15H,13-14H2,1-5H3,(H,25,27)