16-methylheptadecyl (E)-3-(1,2,4-triazol-1-yl)but-2-enoate

Systemtic Name: 16-methylheptadecyl (E)-3-(1,2,4-triazol-1-yl)but-2-enoate Openeye Name: 16-methylheptadecyl (E)-3-(1,2,4-triazol-1-yl)but-2-enoate CAS Name: (E)-3-(1,2,4-triazol-1-yl)-2-butenoic acid 16-methylheptadecyl ester IUPAC Name: 16-methylheptadecyl (E)-3-(1,2,4-triazol-1-yl)but-2-enoate Traditional Name: (E)-3-(1,2,4-triazol-1-yl)but-2-enoic acid 16-methylheptadecyl ester Formula: C24H43N3O2 MolecularWeight: 405.61712

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCCCCCCCCOC(=O)C=C(C)N1C=NC=N1

Isomeric SMILES

CC(C)CCCCCCCCCCCCCCCOC(=O)/C=C(\C)/N1C=NC=N1

InChI

InChI=1S/C24H43N3O2/c1-22(2)17-15-13-11-9-7-5-4-6-8-10-12-14-16-18-29-24(28)19-23(3)27-21-25-20-26-27/h19-22H,4-18H2,1-3H3/b23-19+