5-[(E)-hept-5-en-2-yl]-3-[2-(2-methylpyrrol-1-yl)ethyl]-4-oxidanyl-oxan-2-one

Systemtic Name: 5-[(E)-hept-5-en-2-yl]-3-[2-(2-methylpyrrol-1-yl)ethyl]-4-oxidanyl-oxan-2-one Openeye Name: 4-hydroxy-5-[(E)-1-methylhex-4-enyl]-3-[2-(2-methylpyrrol-1-yl)ethyl]tetrahydropyran-2-one CAS Name: 5-[(E)-hept-5-en-2-yl]-4-hydroxy-3-[2-(2-methyl-1-pyrrolyl)ethyl]-2-oxanone IUPAC Name: 5-[(E)-hept-5-en-2-yl]-4-hydroxy-3-[2-(2-methylpyrrol-1-yl)ethyl]oxan-2-one Traditional Name: 4-hydroxy-5-[(E)-1-methylhex-4-enyl]-3-[2-(2-methylpyrrol-1-yl)ethyl]tetrahydropyran-2-one Formula: C19H29NO3 MolecularWeight: 319.43846

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCCC(C)C1COC(=O)C(C1O)CCN2C=CC=C2C

Isomeric SMILES

C/C=C/CCC(C)C1COC(=O)C(C1O)CCN2C=CC=C2C

InChI

InChI=1S/C19H29NO3/c1-4-5-6-8-14(2)17-13-23-19(22)16(18(17)21)10-12-20-11-7-9-15(20)3/h4-5,7,9,11,14,16-18,21H,6,8,10,12-13H2,1-3H3/b5-4+