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

Systemtic Name: tert-butyl 1-(chloromethyl)-7-methylsulfonyl-1,2-dihydrobenzo[e]indole-3-carboxylate Openeye Name: tert-butyl 1-(chloromethyl)-7-methylsulfonyl-1,2-dihydrobenzo[e]indole-3-carboxylate CAS Name: 1-(chloromethyl)-7-methylsulfonyl-1,2-dihydrobenzo[e]indole-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-(chloromethyl)-7-methylsulfonyl-1,2-dihydrobenzo[e]indole-3-carboxylate Traditional Name: 1-(chloromethyl)-7-mesyl-1,2-dihydrobenz[e]indole-3-carboxylic acid tert-butyl ester Formula: C19H22ClNO4S MolecularWeight: 395.90028

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(C2=C1C=CC3=C2C=CC(=C3)S(=O)(=O)C)CCl

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(C2=C1C=CC3=C2C=CC(=C3)S(=O)(=O)C)CCl

InChI

InChI=1S/C19H22ClNO4S/c1-19(2,3)25-18(22)21-11-13(10-20)17-15-7-6-14(26(4,23)24)9-12(15)5-8-16(17)21/h5-9,13H,10-11H2,1-4H3