(1-nonoxy-4-phenyl-cyclohexa-2,5-dien-1-yl) 4-(1-propoxyethyl)benzoate

Systemtic Name: (1-nonoxy-4-phenyl-cyclohexa-2,5-dien-1-yl) 4-(1-propoxyethyl)benzoate Openeye Name: (1-nonoxy-4-phenyl-cyclohexa-2,5-dien-1-yl) 4-(1-propoxyethyl)benzoate CAS Name: 4-(1-propoxyethyl)benzoic acid (1-nonoxy-4-phenyl-1-cyclohexa-2,5-dienyl) ester IUPAC Name: (1-nonoxy-4-phenylcyclohexa-2,5-dien-1-yl) 4-(1-propoxyethyl)benzoate Traditional Name: 4-(1-propoxyethyl)benzoic acid (1-nonoxy-4-phenyl-cyclohexa-2,5-dien-1-yl) ester Formula: C33H44O4 MolecularWeight: 504.70006

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC1(C=CC(C=C1)C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)C(C)OCCC

Isomeric SMILES

CCCCCCCCCOC1(C=CC(C=C1)C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)C(C)OCCC

InChI

InChI=1S/C33H44O4/c1-4-6-7-8-9-10-14-26-36-33(23-21-30(22-24-33)29-15-12-11-13-16-29)37-32(34)31-19-17-28(18-20-31)27(3)35-25-5-2/h11-13,15-24,27,30H,4-10,14,25-26H2,1-3H3