[2-[[3,3-dimethyl-5-(3-methylbutyl)-4-oxidanylidene-2H-1,5-benzoxazepin-8-yl]carbamoyl]phenyl] ethanoate

Systemtic Name: [2-[[3,3-dimethyl-5-(3-methylbutyl)-4-oxidanylidene-2H-1,5-benzoxazepin-8-yl]carbamoyl]phenyl] ethanoate Openeye Name: [2-[(5-isopentyl-3,3-dimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)carbamoyl]phenyl] acetate CAS Name: acetic acid [2-[[[3,3-dimethyl-5-(3-methylbutyl)-4-oxo-2H-1,5-benzoxazepin-8-yl]amino]-oxomethyl]phenyl] ester IUPAC Name: [2-[[3,3-dimethyl-5-(3-methylbutyl)-4-oxo-2H-1,5-benzoxazepin-8-yl]carbamoyl]phenyl] acetate Traditional Name: acetic acid [2-[(5-isoamyl-4-keto-3,3-dimethyl-2H-1,5-benzoxazepin-8-yl)carbamoyl]phenyl] ester Formula: C25H30N2O5 MolecularWeight: 438.5161

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C2=C(C=C(C=C2)NC(=O)C3=CC=CC=C3OC(=O)C)OCC(C1=O)(C)C

Isomeric SMILES

CC(C)CCN1C2=C(C=C(C=C2)NC(=O)C3=CC=CC=C3OC(=O)C)OCC(C1=O)(C)C

InChI

InChI=1S/C25H30N2O5/c1-16(2)12-13-27-20-11-10-18(14-22(20)31-15-25(4,5)24(27)30)26-23(29)19-8-6-7-9-21(19)32-17(3)28/h6-11,14,16H,12-13,15H2,1-5H3,(H,26,29)