4-[(2-methylpropan-2-yl)oxycarbonyl]-3,5-dihydro-2H-1,4-benzoxazepine-7-carboxylic acid

Systemtic Name: 4-[(2-methylpropan-2-yl)oxycarbonyl]-3,5-dihydro-2H-1,4-benzoxazepine-7-carboxylic acid Openeye Name: 4-tert-butoxycarbonyl-3,5-dihydro-2H-1,4-benzoxazepine-7-carboxylic acid CAS Name: 4-[(2-methylpropan-2-yl)oxy-oxomethyl]-3,5-dihydro-2H-1,4-benzoxazepine-7-carboxylic acid IUPAC Name: 4-[(2-methylpropan-2-yl)oxycarbonyl]-3,5-dihydro-2H-1,4-benzoxazepine-7-carboxylic acid Traditional Name: 4-tert-butoxycarbonyl-3,5-dihydro-2H-1,4-benzoxazepine-7-carboxylic acid Formula: C15H19NO5 MolecularWeight: 293.31506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCOC2=C(C1)C=C(C=C2)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCOC2=C(C1)C=C(C=C2)C(=O)O

InChI

InChI=1S/C15H19NO5/c1-15(2,3)21-14(19)16-6-7-20-12-5-4-10(13(17)18)8-11(12)9-16/h4-5,8H,6-7,9H2,1-3H3,(H,17,18)