(3-chloranyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl) N-tert-butylcarbamate

Systemtic Name: (3-chloranyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl) N-tert-butylcarbamate Openeye Name: (3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl) N-tert-butylcarbamate CAS Name: N-tert-butylcarbamic acid (3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl) ester IUPAC Name: (3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl) N-tert-butylcarbamate Traditional Name: N-tert-butylcarbamic acid (3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl) ester Formula: C19H20ClNO2S MolecularWeight: 361.8856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)OC1CC2=CC=CC=C2SC3=C1C=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)NC(=O)OC1CC2=CC=CC=C2SC3=C1C=C(C=C3)Cl

InChI

InChI=1S/C19H20ClNO2S/c1-19(2,3)21-18(22)23-15-10-12-6-4-5-7-16(12)24-17-9-8-13(20)11-14(15)17/h4-9,11,15H,10H2,1-3H3,(H,21,22)