tert-butyl 8-(chloromethyloxy)-1,3,4,5-tetrahydro-2-benzazepine-2-carboxylate

Systemtic Name: tert-butyl 8-(chloromethyloxy)-1,3,4,5-tetrahydro-2-benzazepine-2-carboxylate Openeye Name: tert-butyl 8-(chloromethoxy)-1,3,4,5-tetrahydro-2-benzazepine-2-carboxylate CAS Name: 8-(chloromethoxy)-1,3,4,5-tetrahydro-2-benzazepine-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 8-(chloromethoxy)-1,3,4,5-tetrahydro-2-benzazepine-2-carboxylate Traditional Name: 8-(chloromethoxy)-1,3,4,5-tetrahydro-2-benzazepine-2-carboxylic acid tert-butyl ester Formula: C16H22ClNO3 MolecularWeight: 311.80378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC2=C(C1)C=C(C=C2)OCCl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC2=C(C1)C=C(C=C2)OCCl

InChI

InChI=1S/C16H22ClNO3/c1-16(2,3)21-15(19)18-8-4-5-12-6-7-14(20-11-17)9-13(12)10-18/h6-7,9H,4-5,8,10-11H2,1-3H3