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

Systemtic Name: [5-[4-(2-butoxyethoxy)phenyl]-2-(3-methylpiperidin-1-yl)phenyl] prop-2-enoate Openeye Name: [5-[4-(2-butoxyethoxy)phenyl]-2-(3-methyl-1-piperidyl)phenyl] prop-2-enoate CAS Name: 2-propenoic acid [5-[4-(2-butoxyethoxy)phenyl]-2-(3-methyl-1-piperidinyl)phenyl] ester IUPAC Name: [5-[4-(2-butoxyethoxy)phenyl]-2-(3-methylpiperidin-1-yl)phenyl] prop-2-enoate Traditional Name: acrylic acid [5-[4-(2-butoxyethoxy)phenyl]-2-(3-methylpiperidino)phenyl] ester Formula: C27H35NO4 MolecularWeight: 437.5711

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCCOC1=CC=C(C=C1)C2=CC(=C(C=C2)N3CCCC(C3)C)OC(=O)C=C

Isomeric SMILES

CCCCOCCOC1=CC=C(C=C1)C2=CC(=C(C=C2)N3CCCC(C3)C)OC(=O)C=C

InChI

InChI=1S/C27H35NO4/c1-4-6-16-30-17-18-31-24-12-9-22(10-13-24)23-11-14-25(26(19-23)32-27(29)5-2)28-15-7-8-21(3)20-28/h5,9-14,19,21H,2,4,6-8,15-18,20H2,1,3H3