tert-butyl 1-(chloromethyl)-7-ethanoyl-1,2-dihydrobenzo[e]indole-3-carboxylate

Systemtic Name: tert-butyl 1-(chloromethyl)-7-ethanoyl-1,2-dihydrobenzo[e]indole-3-carboxylate Openeye Name: tert-butyl 7-acetyl-1-(chloromethyl)-1,2-dihydrobenzo[e]indole-3-carboxylate CAS Name: 7-acetyl-1-(chloromethyl)-1,2-dihydrobenzo[e]indole-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 7-acetyl-1-(chloromethyl)-1,2-dihydrobenzo[e]indole-3-carboxylate Traditional Name: 7-acetyl-1-(chloromethyl)-1,2-dihydrobenz[e]indole-3-carboxylic acid tert-butyl ester Formula: C20H22ClNO3 MolecularWeight: 359.84658

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)C3=C(C=C2)N(CC3CCl)C(=O)OC(C)(C)C

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)C3=C(C=C2)N(CC3CCl)C(=O)OC(C)(C)C

InChI

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