methyl 3-(oxan-2-yloxymethyl)-5-(undec-10-enoylamino)benzoate

Systemtic Name: methyl 3-(oxan-2-yloxymethyl)-5-(undec-10-enoylamino)benzoate Openeye Name: methyl 3-(tetrahydropyran-2-yloxymethyl)-5-(undec-10-enoylamino)benzoate CAS Name: 3-(2-oxanyloxymethyl)-5-(1-oxoundec-10-enylamino)benzoic acid methyl ester IUPAC Name: methyl 3-(oxan-2-yloxymethyl)-5-(undec-10-enoylamino)benzoate Traditional Name: 3-(tetrahydropyran-2-yloxymethyl)-5-(undec-10-enoylamino)benzoic acid methyl ester Formula: C25H37NO5 MolecularWeight: 431.56498

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)CCCCCCCCC=C)COC2CCCCO2

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)CCCCCCCCC=C)COC2CCCCO2

InChI

InChI=1S/C25H37NO5/c1-3-4-5-6-7-8-9-10-13-23(27)26-22-17-20(16-21(18-22)25(28)29-2)19-31-24-14-11-12-15-30-24/h3,16-18,24H,1,4-15,19H2,2H3,(H,26,27)