1-[4-[2,3-bis(hydroxymethyl)-6,7-dimethoxy-naphthalen-1-yl]pyridin-2-yl]piperidin-4-one

Systemtic Name: 1-[4-[2,3-bis(hydroxymethyl)-6,7-dimethoxy-naphthalen-1-yl]pyridin-2-yl]piperidin-4-one Openeye Name: 1-[4-[2,3-bis(hydroxymethyl)-6,7-dimethoxy-1-naphthyl]-2-pyridyl]piperidin-4-one CAS Name: 1-[4-[2,3-bis(hydroxymethyl)-6,7-dimethoxy-1-naphthalenyl]-2-pyridinyl]-4-piperidinone IUPAC Name: 1-[4-[2,3-bis(hydroxymethyl)-6,7-dimethoxynaphthalen-1-yl]pyridin-2-yl]piperidin-4-one Traditional Name: 1-[4-(6,7-dimethoxy-2,3-dimethylol-1-naphthyl)-2-pyridyl]-4-piperidone Formula: C24H26N2O5 MolecularWeight: 422.47364

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=CC(=C(C(=C2C=C1OC)C3=CC(=NC=C3)N4CCC(=O)CC4)CO)CO

Isomeric SMILES

COC1=CC2=CC(=C(C(=C2C=C1OC)C3=CC(=NC=C3)N4CCC(=O)CC4)CO)CO

InChI

InChI=1S/C24H26N2O5/c1-30-21-10-16-9-17(13-27)20(14-28)24(19(16)12-22(21)31-2)15-3-6-25-23(11-15)26-7-4-18(29)5-8-26/h3,6,9-12,27-28H,4-5,7-8,13-14H2,1-2H3