(phenylmethyl) N-[2-ethyl-4-(3-methoxypropyl)-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]carbamate

Systemtic Name: (phenylmethyl) N-[2-ethyl-4-(3-methoxypropyl)-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]carbamate Openeye Name: benzyl N-[2-ethyl-4-(3-methoxypropyl)-3-oxo-5H-1,4-benzoxazepin-7-yl]carbamate CAS Name: N-[2-ethyl-4-(3-methoxypropyl)-3-oxo-5H-1,4-benzoxazepin-7-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[2-ethyl-4-(3-methoxypropyl)-3-oxo-5H-1,4-benzoxazepin-7-yl]carbamate Traditional Name: N-[2-ethyl-3-keto-4-(3-methoxypropyl)-5H-1,4-benzoxazepin-7-yl]carbamic acid benzyl ester Formula: C23H28N2O5 MolecularWeight: 412.47882

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)OCC3=CC=CC=C3)CCCOC

Isomeric SMILES

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)OCC3=CC=CC=C3)CCCOC

InChI

InChI=1S/C23H28N2O5/c1-3-20-22(26)25(12-7-13-28-2)15-18-14-19(10-11-21(18)30-20)24-23(27)29-16-17-8-5-4-6-9-17/h4-6,8-11,14,20H,3,7,12-13,15-16H2,1-2H3,(H,24,27)