[4-[1-[(E)-3-(4-methoxyphenyl)prop-2-enyl]piperidin-1-ium-4-yl]oxyphenyl]-piperidin-1-yl-methanone

Systemtic Name: [4-[1-[(E)-3-(4-methoxyphenyl)prop-2-enyl]piperidin-1-ium-4-yl]oxyphenyl]-piperidin-1-yl-methanone Openeye Name: [4-[1-[(E)-3-(4-methoxyphenyl)allyl]piperidin-1-ium-4-yl]oxyphenyl]-(1-piperidyl)methanone CAS Name: [4-[[1-[(E)-3-(4-methoxyphenyl)prop-2-enyl]-4-piperidin-1-iumyl]oxy]phenyl]-(1-piperidinyl)methanone IUPAC Name: [4-[1-[(E)-3-(4-methoxyphenyl)prop-2-enyl]piperidin-1-ium-4-yl]oxyphenyl]-piperidin-1-ylmethanone Traditional Name: [4-[1-[(E)-3-(4-methoxyphenyl)allyl]piperidin-1-ium-4-yl]oxyphenyl]-piperidino-methanone Formula: C27H35N2O3+ MolecularWeight: 435.5784

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=CC[NH+]2CCC(CC2)OC3=CC=C(C=C3)C(=O)N4CCCCC4

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/C[NH+]2CCC(CC2)OC3=CC=C(C=C3)C(=O)N4CCCCC4

InChI

InChI=1S/C27H34N2O3/c1-31-24-11-7-22(8-12-24)6-5-17-28-20-15-26(16-21-28)32-25-13-9-23(10-14-25)27(30)29-18-3-2-4-19-29/h5-14,26H,2-4,15-21H2,1H3/p+1/b6-5+