methyl 7-chloranyl-6-(methylamino)-2,3,4,5-tetrahydro-1,5-benzoxazepine-9-carboxylate

Systemtic Name: methyl 7-chloranyl-6-(methylamino)-2,3,4,5-tetrahydro-1,5-benzoxazepine-9-carboxylate Openeye Name: methyl 7-chloro-6-(methylamino)-2,3,4,5-tetrahydro-1,5-benzoxazepine-9-carboxylate CAS Name: 7-chloro-6-(methylamino)-2,3,4,5-tetrahydro-1,5-benzoxazepine-9-carboxylic acid methyl ester IUPAC Name: methyl 7-chloro-6-(methylamino)-2,3,4,5-tetrahydro-1,5-benzoxazepine-9-carboxylate Traditional Name: 7-chloro-6-(methylamino)-2,3,4,5-tetrahydro-1,5-benzoxazepine-9-carboxylic acid methyl ester Formula: C12H15ClN2O3 MolecularWeight: 270.7121

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C2=C1NCCCO2)C(=O)OC)Cl

Isomeric SMILES

CNC1=C(C=C(C2=C1NCCCO2)C(=O)OC)Cl

InChI

InChI=1S/C12H15ClN2O3/c1-14-9-8(13)6-7(12(16)17-2)11-10(9)15-4-3-5-18-11/h6,14-15H,3-5H2,1-2H3