methyl N-[5-hexadecoxycarbonyloxy-3-(methoxycarbonylamino)-2-oxidanyl-phenyl]methanimidate

Systemtic Name: methyl N-[5-hexadecoxycarbonyloxy-3-(methoxycarbonylamino)-2-oxidanyl-phenyl]methanimidate Openeye Name: methyl N-[5-hexadecoxycarbonyloxy-2-hydroxy-3-(methoxycarbonylamino)phenyl]methanimidate CAS Name: N-[5-[hexadecoxy(oxo)methoxy]-2-hydroxy-3-(methoxycarbonylamino)phenyl]methanimidic acid methyl ester IUPAC Name: methyl N-[5-hexadecoxycarbonyloxy-2-hydroxy-3-(methoxycarbonylamino)phenyl]methanimidate Traditional Name: N-[3-(carbomethoxyamino)-5-cetyloxycarbonyloxy-2-hydroxy-phenyl]formimidic acid methyl ester Formula: C27H44N2O7 MolecularWeight: 508.64746

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(=O)OC1=CC(=C(C(=C1)N=COC)O)NC(=O)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(=O)OC1=CC(=C(C(=C1)N=COC)O)NC(=O)OC

InChI

InChI=1S/C27H44N2O7/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-35-27(32)36-22-19-23(28-21-33-2)25(30)24(20-22)29-26(31)34-3/h19-21,30H,4-18H2,1-3H3,(H,29,31)