tert-butyl 3-chloranyl-6H-benzo[b][1,4]benzoxazepine-5-carboxylate

Systemtic Name: tert-butyl 3-chloranyl-6H-benzo[b][1,4]benzoxazepine-5-carboxylate Openeye Name: tert-butyl 3-chloro-6H-benzo[b][1,4]benzoxazepine-5-carboxylate CAS Name: 3-chloro-6H-benzo[b][1,4]benzoxazepine-5-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-chloro-6H-benzo[b][1,4]benzoxazepine-5-carboxylate Traditional Name: 3-chloro-6H-benzo[b][1,4]benzoxazepine-5-carboxylic acid tert-butyl ester Formula: C18H18ClNO3 MolecularWeight: 331.79342

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC2=CC=CC=C2OC3=C1C=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CC2=CC=CC=C2OC3=C1C=C(C=C3)Cl

InChI

InChI=1S/C18H18ClNO3/c1-18(2,3)23-17(21)20-11-12-6-4-5-7-15(12)22-16-9-8-13(19)10-14(16)20/h4-10H,11H2,1-3H3