ethyl 3-(3,4-dihydro-1H-isoquinolin-2-ylhydrazinylidene)-5-methoxy-indole-2-carboxylate

Systemtic Name: ethyl 3-(3,4-dihydro-1H-isoquinolin-2-ylhydrazinylidene)-5-methoxy-indole-2-carboxylate Openeye Name: ethyl 3-(3,4-dihydro-1H-isoquinolin-2-ylhydrazono)-5-methoxy-indole-2-carboxylate CAS Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylhydrazinylidene)-5-methoxy-2-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(3,4-dihydro-1H-isoquinolin-2-ylhydrazinylidene)-5-methoxyindole-2-carboxylate Traditional Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylhydrazono)-5-methoxy-indole-2-carboxylic acid ethyl ester Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC2=C(C1=NNN3CCC4=CC=CC=C4C3)C=C(C=C2)OC

Isomeric SMILES

CCOC(=O)C1=NC2=C(C1=NNN3CCC4=CC=CC=C4C3)C=C(C=C2)OC

InChI

InChI=1S/C21H22N4O3/c1-3-28-21(26)20-19(17-12-16(27-2)8-9-18(17)22-20)23-24-25-11-10-14-6-4-5-7-15(14)13-25/h4-9,12,24H,3,10-11,13H2,1-2H3