3-(4-methoxyphenyl)-1'-(phenylmethyl)spiro[1H-quinazoline-2,4'-piperidin-1-ium]-4-one

Systemtic Name: 3-(4-methoxyphenyl)-1'-(phenylmethyl)spiro[1H-quinazoline-2,4'-piperidin-1-ium]-4-one Openeye Name: 1'-benzyl-3-(4-methoxyphenyl)spiro[1H-quinazoline-2,4'-piperidin-1-ium]-4-one CAS Name: 3-(4-methoxyphenyl)-1'-(phenylmethyl)-4-spiro[1H-quinazoline-2,4'-piperidin-1-ium]one IUPAC Name: 1'-benzyl-3-(4-methoxyphenyl)spiro[1H-quinazoline-2,4'-piperidin-1-ium]-4-one Traditional Name: 1'-benzyl-3-(4-methoxyphenyl)spiro[1H-quinazoline-2,4'-piperidin-1-ium]-4-one Formula: C26H28N3O2+ MolecularWeight: 414.51942

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3NC24CC[NH+](CC4)CC5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3NC24CC[NH+](CC4)CC5=CC=CC=C5

InChI

InChI=1S/C26H27N3O2/c1-31-22-13-11-21(12-14-22)29-25(30)23-9-5-6-10-24(23)27-26(29)15-17-28(18-16-26)19-20-7-3-2-4-8-20/h2-14,27H,15-19H2,1H3/p+1