methyl 3-[(Z)-1-(3,4-dipentoxyphenyl)-3-oxidanyl-prop-1-en-2-yl]benzoate

Systemtic Name: methyl 3-[(Z)-1-(3,4-dipentoxyphenyl)-3-oxidanyl-prop-1-en-2-yl]benzoate Openeye Name: methyl 3-[(Z)-2-(3,4-dipentoxyphenyl)-1-(hydroxymethyl)vinyl]benzoate CAS Name: 3-[(Z)-1-(3,4-dipentoxyphenyl)-3-hydroxyprop-1-en-2-yl]benzoic acid methyl ester IUPAC Name: methyl 3-[(Z)-1-(3,4-dipentoxyphenyl)-3-hydroxyprop-1-en-2-yl]benzoate Traditional Name: 3-[(Z)-2-(3,4-diamoxyphenyl)-1-methylol-vinyl]benzoic acid methyl ester Formula: C27H36O5 MolecularWeight: 440.57174

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1)C=C(CO)C2=CC(=CC=C2)C(=O)OC)OCCCCC

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1)/C=C(\CO)/C2=CC(=CC=C2)C(=O)OC)OCCCCC

InChI

InChI=1S/C27H36O5/c1-4-6-8-15-31-25-14-13-21(18-26(25)32-16-9-7-5-2)17-24(20-28)22-11-10-12-23(19-22)27(29)30-3/h10-14,17-19,28H,4-9,15-16,20H2,1-3H3/b24-17+