ethyl 7-chloranyl-2-(2-ethoxy-2-oxidanylidene-ethyl)-1-methyl-10-oxidanylidene-4,5-dihydro-1H-cyclohepta[b]indole-3-carboxylate

Systemtic Name: ethyl 7-chloranyl-2-(2-ethoxy-2-oxidanylidene-ethyl)-1-methyl-10-oxidanylidene-4,5-dihydro-1H-cyclohepta[b]indole-3-carboxylate Openeye Name: ethyl 7-chloro-2-(2-ethoxy-2-oxo-ethyl)-1-methyl-10-oxo-4,5-dihydro-1H-cyclohepta[b]indole-3-carboxylate CAS Name: 7-chloro-2-(2-ethoxy-2-oxoethyl)-1-methyl-10-oxo-4,5-dihydro-1H-cyclohepta[b]indole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 7-chloro-2-(2-ethoxy-2-oxoethyl)-1-methyl-10-oxo-4,5-dihydro-1H-cyclohepta[b]indole-3-carboxylate Traditional Name: 7-chloro-2-(2-ethoxy-2-keto-ethyl)-10-keto-1-methyl-4,5-dihydro-1H-cyclohept[b]indole-3-carboxylic acid ethyl ester Formula: C21H22ClNO5 MolecularWeight: 403.85608

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=C(CC2=C(C1C)C3=C(N2)C=C(C=CC3=O)Cl)C(=O)OCC

Isomeric SMILES

CCOC(=O)CC1=C(CC2=C(C1C)C3=C(N2)C=C(C=CC3=O)Cl)C(=O)OCC

InChI

InChI=1S/C21H22ClNO5/c1-4-27-18(25)10-13-11(3)19-16(9-14(13)21(26)28-5-2)23-15-8-12(22)6-7-17(24)20(15)19/h6-8,11,23H,4-5,9-10H2,1-3H3