ethyl 6,7-dimethoxy-4-(4-methoxy-3-propoxy-phenyl)-2-(1,2,4-triazol-1-ylmethyl)quinoline-3-carboxylate

Systemtic Name: ethyl 6,7-dimethoxy-4-(4-methoxy-3-propoxy-phenyl)-2-(1,2,4-triazol-1-ylmethyl)quinoline-3-carboxylate Openeye Name: ethyl 6,7-dimethoxy-4-(4-methoxy-3-propoxy-phenyl)-2-(1,2,4-triazol-1-ylmethyl)quinoline-3-carboxylate CAS Name: 6,7-dimethoxy-4-(4-methoxy-3-propoxyphenyl)-2-(1,2,4-triazol-1-ylmethyl)-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 6,7-dimethoxy-4-(4-methoxy-3-propoxyphenyl)-2-(1,2,4-triazol-1-ylmethyl)quinoline-3-carboxylate Traditional Name: 6,7-dimethoxy-4-(4-methoxy-3-propoxy-phenyl)-2-(1,2,4-triazol-1-ylmethyl)quinoline-3-carboxylic acid ethyl ester Formula: C27H30N4O6 MolecularWeight: 506.5503

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=CC(=C1)C2=C(C(=NC3=CC(=C(C=C32)OC)OC)CN4C=NC=N4)C(=O)OCC)OC

Isomeric SMILES

CCCOC1=C(C=CC(=C1)C2=C(C(=NC3=CC(=C(C=C32)OC)OC)CN4C=NC=N4)C(=O)OCC)OC

InChI

InChI=1S/C27H30N4O6/c1-6-10-37-24-11-17(8-9-21(24)33-3)25-18-12-22(34-4)23(35-5)13-19(18)30-20(14-31-16-28-15-29-31)26(25)27(32)36-7-2/h8-9,11-13,15-16H,6-7,10,14H2,1-5H3