[(E)-7-[3-methyl-2-[(E)-3-methyl-3-oxidanyl-oct-1-enyl]-5-oxidanylidene-cyclopentyl]hept-5-enyl] N-phenylcarbamate

Systemtic Name: [(E)-7-[3-methyl-2-[(E)-3-methyl-3-oxidanyl-oct-1-enyl]-5-oxidanylidene-cyclopentyl]hept-5-enyl] N-phenylcarbamate Openeye Name: [(E)-7-[2-[(E)-3-hydroxy-3-methyl-oct-1-enyl]-3-methyl-5-oxo-cyclopentyl]hept-5-enyl] N-phenylcarbamate CAS Name: N-phenylcarbamic acid [(E)-7-[2-[(E)-3-hydroxy-3-methyloct-1-enyl]-3-methyl-5-oxocyclopentyl]hept-5-enyl] ester IUPAC Name: [(E)-7-[2-[(E)-3-hydroxy-3-methyloct-1-enyl]-3-methyl-5-oxocyclopentyl]hept-5-enyl] N-phenylcarbamate Traditional Name: N-phenylcarbamic acid [(E)-7-[2-[(E)-3-hydroxy-3-methyl-oct-1-enyl]-5-keto-3-methyl-cyclopentyl]hept-5-enyl] ester Formula: C29H43NO4 MolecularWeight: 469.65602

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)(C=CC1C(CC(=O)C1CC=CCCCCOC(=O)NC2=CC=CC=C2)C)O

Isomeric SMILES

CCCCCC(C)(/C=C/C1C(CC(=O)C1C/C=C/CCCCOC(=O)NC2=CC=CC=C2)C)O

InChI

InChI=1S/C29H43NO4/c1-4-5-13-19-29(3,33)20-18-25-23(2)22-27(31)26(25)17-12-7-6-8-14-21-34-28(32)30-24-15-10-9-11-16-24/h7,9-12,15-16,18,20,23,25-26,33H,4-6,8,13-14,17,19,21-22H2,1-3H3,(H,30,32)/b12-7+,20-18+