3-[(E)-3-(1-cyclohexyl-2,5-dimethyl-pyrrol-3-yl)prop-2-enoyl]-6-methyl-2-oxidanyl-pyran-4-one

Systemtic Name: 3-[(E)-3-(1-cyclohexyl-2,5-dimethyl-pyrrol-3-yl)prop-2-enoyl]-6-methyl-2-oxidanyl-pyran-4-one Openeye Name: 3-[(E)-3-(1-cyclohexyl-2,5-dimethyl-pyrrol-3-yl)prop-2-enoyl]-2-hydroxy-6-methyl-pyran-4-one CAS Name: 3-[(E)-3-(1-cyclohexyl-2,5-dimethyl-3-pyrrolyl)-1-oxoprop-2-enyl]-2-hydroxy-6-methyl-4-pyranone IUPAC Name: 3-[(E)-3-(1-cyclohexyl-2,5-dimethylpyrrol-3-yl)prop-2-enoyl]-2-hydroxy-6-methylpyran-4-one Traditional Name: 3-[(E)-3-(1-cyclohexyl-2,5-dimethyl-pyrrol-3-yl)acryloyl]-2-hydroxy-6-methyl-pyran-4-one Formula: C21H25NO4 MolecularWeight: 355.4275

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2CCCCC2)C)C=CC(=O)C3=C(OC(=CC3=O)C)O

Isomeric SMILES

CC1=CC(=C(N1C2CCCCC2)C)/C=C/C(=O)C3=C(OC(=CC3=O)C)O

InChI

InChI=1S/C21H25NO4/c1-13-11-16(15(3)22(13)17-7-5-4-6-8-17)9-10-18(23)20-19(24)12-14(2)26-21(20)25/h9-12,17,25H,4-8H2,1-3H3/b10-9+