ethyl 7-(chloromethyl)-3-(4-methoxy-4-oxidanylidene-butyl)-7,7a-dihydro-1H-indole-2-carboxylate

Systemtic Name: ethyl 7-(chloromethyl)-3-(4-methoxy-4-oxidanylidene-butyl)-7,7a-dihydro-1H-indole-2-carboxylate Openeye Name: ethyl 7-(chloromethyl)-3-(4-methoxy-4-oxo-butyl)-7,7a-dihydro-1H-indole-2-carboxylate CAS Name: 7-(chloromethyl)-3-(4-methoxy-4-oxobutyl)-7,7a-dihydro-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 7-(chloromethyl)-3-(4-methoxy-4-oxobutyl)-7,7a-dihydro-1H-indole-2-carboxylate Traditional Name: 7-(chloromethyl)-3-(4-keto-4-methoxy-butyl)-7,7a-dihydro-1H-indole-2-carboxylic acid ethyl ester Formula: C17H22ClNO4 MolecularWeight: 339.81388

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC(C2N1)CCl)CCCC(=O)OC

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC(C2N1)CCl)CCCC(=O)OC

InChI

InChI=1S/C17H22ClNO4/c1-3-23-17(21)16-13(8-5-9-14(20)22-2)12-7-4-6-11(10-18)15(12)19-16/h4,6-7,11,15,19H,3,5,8-10H2,1-2H3