3-ethanoyl-1-hexadecyl-2-(3-methoxy-4-oxidanyl-phenyl)-4-oxidanyl-2H-pyrrol-5-one

Systemtic Name: 3-ethanoyl-1-hexadecyl-2-(3-methoxy-4-oxidanyl-phenyl)-4-oxidanyl-2H-pyrrol-5-one Openeye Name: 3-acetyl-1-hexadecyl-4-hydroxy-2-(4-hydroxy-3-methoxy-phenyl)-2H-pyrrol-5-one CAS Name: 3-acetyl-1-hexadecyl-4-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-2H-pyrrol-5-one IUPAC Name: 3-acetyl-1-hexadecyl-4-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-2H-pyrrol-5-one Traditional Name: 4-acetyl-1-cetyl-3-hydroxy-5-(4-hydroxy-3-methoxy-phenyl)-3-pyrrolin-2-one Formula: C29H45NO5 MolecularWeight: 487.6713

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCN1C(C(=C(C1=O)O)C(=O)C)C2=CC(=C(C=C2)O)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCN1C(C(=C(C1=O)O)C(=O)C)C2=CC(=C(C=C2)O)OC

InChI

InChI=1S/C29H45NO5/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-30-27(26(22(2)31)28(33)29(30)34)23-18-19-24(32)25(21-23)35-3/h18-19,21,27,32-33H,4-17,20H2,1-3H3