4-(1-decoxy-4-phenyl-cyclohexa-2,5-dien-1-yl)butan-2-yl propanoate

Systemtic Name: 4-(1-decoxy-4-phenyl-cyclohexa-2,5-dien-1-yl)butan-2-yl propanoate Openeye Name: [3-(1-decoxy-4-phenyl-cyclohexa-2,5-dien-1-yl)-1-methyl-propyl] propanoate CAS Name: propanoic acid 4-(1-decoxy-4-phenyl-1-cyclohexa-2,5-dienyl)butan-2-yl ester IUPAC Name: 4-(1-decoxy-4-phenylcyclohexa-2,5-dien-1-yl)butan-2-yl propanoate Traditional Name: propionic acid [3-(1-decoxy-4-phenyl-cyclohexa-2,5-dien-1-yl)-1-methyl-propyl] ester Formula: C29H44O3 MolecularWeight: 440.65786

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1(C=CC(C=C1)C2=CC=CC=C2)CCC(C)OC(=O)CC

Isomeric SMILES

CCCCCCCCCCOC1(C=CC(C=C1)C2=CC=CC=C2)CCC(C)OC(=O)CC

InChI

InChI=1S/C29H44O3/c1-4-6-7-8-9-10-11-15-24-31-29(21-18-25(3)32-28(30)5-2)22-19-27(20-23-29)26-16-13-12-14-17-26/h12-14,16-17,19-20,22-23,25,27H,4-11,15,18,21,24H2,1-3H3