1-[(3R)-1-(4-methoxyphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]-4-phenyl-piperidin-1-ium-4-carbonitrile

Systemtic Name: 1-[(3R)-1-(4-methoxyphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]-4-phenyl-piperidin-1-ium-4-carbonitrile Openeye Name: 1-[(3R)-1-(4-methoxyphenyl)-2,5-dioxo-pyrrolidin-3-yl]-4-phenyl-piperidin-1-ium-4-carbonitrile CAS Name: 1-[(3R)-1-(4-methoxyphenyl)-2,5-dioxo-3-pyrrolidinyl]-4-phenyl-4-piperidin-1-iumcarbonitrile IUPAC Name: 1-[(3R)-1-(4-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl]-4-phenylpiperidin-1-ium-4-carbonitrile Traditional Name: 1-[(3R)-2,5-diketo-1-(4-methoxyphenyl)pyrrolidin-3-yl]-4-phenyl-piperidin-1-ium-4-carbonitrile Formula: C23H24N3O3+ MolecularWeight: 390.45496

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=O)CC(C2=O)[NH+]3CCC(CC3)(C#N)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=O)C[C@H](C2=O)[NH+]3CCC(CC3)(C#N)C4=CC=CC=C4

InChI

InChI=1S/C23H23N3O3/c1-29-19-9-7-18(8-10-19)26-21(27)15-20(22(26)28)25-13-11-23(16-24,12-14-25)17-5-3-2-4-6-17/h2-10,20H,11-15H2,1H3/p+1/t20-/m1/s1