ethyl 2-[1,3-bis(phenylmethoxy)butan-2-yloxymethyl]-1,2,4-triazole-3-carboxylate

Systemtic Name: ethyl 2-[1,3-bis(phenylmethoxy)butan-2-yloxymethyl]-1,2,4-triazole-3-carboxylate Openeye Name: ethyl 2-[[2-benzyloxy-1-(benzyloxymethyl)propoxy]methyl]-1,2,4-triazole-3-carboxylate CAS Name: 2-[1,3-bis(phenylmethoxy)butan-2-yloxymethyl]-1,2,4-triazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[1,3-bis(phenylmethoxy)butan-2-yloxymethyl]-1,2,4-triazole-3-carboxylate Traditional Name: 2-[[2-benzoxy-1-(benzoxymethyl)propoxy]methyl]-1,2,4-triazole-3-carboxylic acid ethyl ester Formula: C24H29N3O5 MolecularWeight: 439.50416

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC=NN1COC(COCC2=CC=CC=C2)C(C)OCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=NC=NN1COC(COCC2=CC=CC=C2)C(C)OCC3=CC=CC=C3

InChI

InChI=1S/C24H29N3O5/c1-3-30-24(28)23-25-17-26-27(23)18-32-22(16-29-14-20-10-6-4-7-11-20)19(2)31-15-21-12-8-5-9-13-21/h4-13,17,19,22H,3,14-16,18H2,1-2H3