butyl 4-[(8-methyl-1-benzoxepin-4-yl)carbonylamino]benzoate

Systemtic Name: butyl 4-[(8-methyl-1-benzoxepin-4-yl)carbonylamino]benzoate Openeye Name: butyl 4-[(8-methyl-1-benzoxepine-4-carbonyl)amino]benzoate CAS Name: 4-[[(8-methyl-1-benzoxepin-4-yl)-oxomethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[(8-methyl-1-benzoxepine-4-carbonyl)amino]benzoate Traditional Name: 4-[(8-methyl-1-benzoxepin-4-carbonyl)amino]benzoic acid butyl ester Formula: C23H23NO4 MolecularWeight: 377.43302

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC3=C(C=C(C=C3)C)OC=C2

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC3=C(C=C(C=C3)C)OC=C2

InChI

InChI=1S/C23H23NO4/c1-3-4-12-28-23(26)17-7-9-20(10-8-17)24-22(25)19-11-13-27-21-14-16(2)5-6-18(21)15-19/h5-11,13-15H,3-4,12H2,1-2H3,(H,24,25)