[5-[4-(2-butoxyethoxy)phenyl]-2-(3-methylpyrrolidin-1-yl)phenyl] prop-2-enoate

Systemtic Name: [5-[4-(2-butoxyethoxy)phenyl]-2-(3-methylpyrrolidin-1-yl)phenyl] prop-2-enoate Openeye Name: [5-[4-(2-butoxyethoxy)phenyl]-2-(3-methylpyrrolidin-1-yl)phenyl] prop-2-enoate CAS Name: 2-propenoic acid [5-[4-(2-butoxyethoxy)phenyl]-2-(3-methyl-1-pyrrolidinyl)phenyl] ester IUPAC Name: [5-[4-(2-butoxyethoxy)phenyl]-2-(3-methylpyrrolidin-1-yl)phenyl] prop-2-enoate Traditional Name: acrylic acid [5-[4-(2-butoxyethoxy)phenyl]-2-(3-methylpyrrolidino)phenyl] ester Formula: C26H33NO4 MolecularWeight: 423.54452

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCCOC1=CC=C(C=C1)C2=CC(=C(C=C2)N3CCC(C3)C)OC(=O)C=C

Isomeric SMILES

CCCCOCCOC1=CC=C(C=C1)C2=CC(=C(C=C2)N3CCC(C3)C)OC(=O)C=C

InChI

InChI=1S/C26H33NO4/c1-4-6-15-29-16-17-30-23-10-7-21(8-11-23)22-9-12-24(27-14-13-20(3)19-27)25(18-22)31-26(28)5-2/h5,7-12,18,20H,2,4,6,13-17,19H2,1,3H3