tert-butyl 1-(chloromethyl)-8-ethanoyl-1,2-dihydrobenzo[e]indole-3-carboxylate

Systemtic Name: tert-butyl 1-(chloromethyl)-8-ethanoyl-1,2-dihydrobenzo[e]indole-3-carboxylate Openeye Name: tert-butyl 8-acetyl-1-(chloromethyl)-1,2-dihydrobenzo[e]indole-3-carboxylate CAS Name: 8-acetyl-1-(chloromethyl)-1,2-dihydrobenzo[e]indole-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 8-acetyl-1-(chloromethyl)-1,2-dihydrobenzo[e]indole-3-carboxylate Traditional Name: 8-acetyl-1-(chloromethyl)-1,2-dihydrobenz[e]indole-3-carboxylic acid tert-butyl ester Formula: C20H22ClNO3 MolecularWeight: 359.84658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)C=CC3=C2C(CN3C(=O)OC(C)(C)C)CCl

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)C=CC3=C2C(CN3C(=O)OC(C)(C)C)CCl

InChI

InChI=1S/C20H22ClNO3/c1-12(23)14-6-5-13-7-8-17-18(16(13)9-14)15(10-21)11-22(17)19(24)25-20(2,3)4/h5-9,15H,10-11H2,1-4H3