propan-2-yl 1-(4-azanyl-1,2,5-oxadiazol-3-yl)-5-(3-methoxy-4-propoxy-phenyl)-1,2,3-triazole-4-carboxylate

Systemtic Name: propan-2-yl 1-(4-azanyl-1,2,5-oxadiazol-3-yl)-5-(3-methoxy-4-propoxy-phenyl)-1,2,3-triazole-4-carboxylate Openeye Name: isopropyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(3-methoxy-4-propoxy-phenyl)triazole-4-carboxylate CAS Name: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(3-methoxy-4-propoxyphenyl)-4-triazolecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(3-methoxy-4-propoxyphenyl)triazole-4-carboxylate Traditional Name: 1-(4-aminofurazan-3-yl)-5-(3-methoxy-4-propoxy-phenyl)triazole-4-carboxylic acid isopropyl ester Formula: C18H22N6O5 MolecularWeight: 402.40448

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C2=C(N=NN2C3=NON=C3N)C(=O)OC(C)C)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C2=C(N=NN2C3=NON=C3N)C(=O)OC(C)C)OC

InChI

InChI=1S/C18H22N6O5/c1-5-8-27-12-7-6-11(9-13(12)26-4)15-14(18(25)28-10(2)3)20-23-24(15)17-16(19)21-29-22-17/h6-7,9-10H,5,8H2,1-4H3,(H2,19,21)