[4-[(1-ethylpiperidin-1-ium-1-yl)methoxy]phenyl]-(2-phenyl-1-benzofuran-3-yl)methanone

Systemtic Name: [4-[(1-ethylpiperidin-1-ium-1-yl)methoxy]phenyl]-(2-phenyl-1-benzofuran-3-yl)methanone Openeye Name: [4-[(1-ethylpiperidin-1-ium-1-yl)methoxy]phenyl]-(2-phenylbenzofuran-3-yl)methanone CAS Name: [4-[(1-ethyl-1-piperidin-1-iumyl)methoxy]phenyl]-(2-phenyl-3-benzofuranyl)methanone IUPAC Name: [4-[(1-ethylpiperidin-1-ium-1-yl)methoxy]phenyl]-(2-phenyl-1-benzofuran-3-yl)methanone Traditional Name: [4-[(1-ethylpiperidin-1-ium-1-yl)methoxy]phenyl]-(2-phenylbenzofuran-3-yl)methanone Formula: C29H30NO3+ MolecularWeight: 440.5534

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(CCCCC1)COC2=CC=C(C=C2)C(=O)C3=C(OC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

CC[N+]1(CCCCC1)COC2=CC=C(C=C2)C(=O)C3=C(OC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C29H30NO3/c1-2-30(19-9-4-10-20-30)21-32-24-17-15-22(16-18-24)28(31)27-25-13-7-8-14-26(25)33-29(27)23-11-5-3-6-12-23/h3,5-8,11-18H,2,4,9-10,19-21H2,1H3/q+1