[5-[(4-tert-butylphenyl)methoxy]-4-methoxy-2-[(E)-non-1-enyl]oxan-3-yl] 2-azanylethanoate

Systemtic Name: [5-[(4-tert-butylphenyl)methoxy]-4-methoxy-2-[(E)-non-1-enyl]oxan-3-yl] 2-azanylethanoate Openeye Name: [5-[(4-tert-butylphenyl)methoxy]-4-methoxy-2-[(E)-non-1-enyl]tetrahydropyran-3-yl] 2-aminoacetate CAS Name: 2-aminoacetic acid [5-[(4-tert-butylphenyl)methoxy]-4-methoxy-2-[(E)-non-1-enyl]-3-oxanyl] ester IUPAC Name: [5-[(4-tert-butylphenyl)methoxy]-4-methoxy-2-[(E)-non-1-enyl]oxan-3-yl] 2-aminoacetate Traditional Name: 2-aminoacetic acid [5-(4-tert-butylbenzyl)oxy-4-methoxy-2-[(E)-non-1-enyl]tetrahydropyran-3-yl] ester Formula: C28H45NO5 MolecularWeight: 475.6606

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC=CC1C(C(C(CO1)OCC2=CC=C(C=C2)C(C)(C)C)OC)OC(=O)CN

Isomeric SMILES

CCCCCCC/C=C/C1C(C(C(CO1)OCC2=CC=C(C=C2)C(C)(C)C)OC)OC(=O)CN

InChI

InChI=1S/C28H45NO5/c1-6-7-8-9-10-11-12-13-23-27(34-25(30)18-29)26(31-5)24(20-33-23)32-19-21-14-16-22(17-15-21)28(2,3)4/h12-17,23-24,26-27H,6-11,18-20,29H2,1-5H3/b13-12+