1-[2-(2,6-diphenylpyran-4-ylidene)-3-piperidin-1-ium-1-ylidene-propylidene]piperidin-1-ium

Systemtic Name: 1-[2-(2,6-diphenylpyran-4-ylidene)-3-piperidin-1-ium-1-ylidene-propylidene]piperidin-1-ium Openeye Name: 1-[2-(2,6-diphenylpyran-4-ylidene)-3-piperidin-1-ium-1-ylidene-propylidene]piperidin-1-ium CAS Name: 1-[2-(2,6-diphenyl-4-pyranylidene)-3-(1-piperidin-1-iumylidene)propylidene]piperidin-1-ium IUPAC Name: 1-[2-(2,6-diphenylpyran-4-ylidene)-3-piperidin-1-ium-1-ylidenepropylidene]piperidin-1-ium Traditional Name: 1-[2-(2,6-diphenylpyran-4-ylidene)-3-piperidin-1-ium-1-ylidene-propylidene]piperidin-1-ium Formula: C30H34N2O+2 MolecularWeight: 438.60376

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](=CC(=C2C=C(OC(=C2)C3=CC=CC=C3)C4=CC=CC=C4)C=[N+]5CCCCC5)CC1

Isomeric SMILES

C1CC[N+](=CC(=C2C=C(OC(=C2)C3=CC=CC=C3)C4=CC=CC=C4)C=[N+]5CCCCC5)CC1

InChI

InChI=1S/C30H34N2O/c1-5-13-25(14-6-1)29-21-27(22-30(33-29)26-15-7-2-8-16-26)28(23-31-17-9-3-10-18-31)24-32-19-11-4-12-20-32/h1-2,5-8,13-16,21-24H,3-4,9-12,17-20H2/q+2