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

Systemtic Name: ethyl 7-(chloromethyl)-3-(3-methoxy-3-oxidanylidene-propyl)-7,7a-dihydro-1H-indole-2-carboxylate Openeye Name: ethyl 7-(chloromethyl)-3-(3-methoxy-3-oxo-propyl)-7,7a-dihydro-1H-indole-2-carboxylate CAS Name: 7-(chloromethyl)-3-(3-methoxy-3-oxopropyl)-7,7a-dihydro-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 7-(chloromethyl)-3-(3-methoxy-3-oxopropyl)-7,7a-dihydro-1H-indole-2-carboxylate Traditional Name: 7-(chloromethyl)-3-(3-keto-3-methoxy-propyl)-7,7a-dihydro-1H-indole-2-carboxylic acid ethyl ester Formula: C16H20ClNO4 MolecularWeight: 325.7873

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20ClNO4/c1-3-22-16(20)15-12(7-8-13(19)21-2)11-6-4-5-10(9-17)14(11)18-15/h4-6,10,14,18H,3,7-9H2,1-2H3