2-[4-[2,3-bis(hydroxymethyl)-7-methoxy-6-propan-2-yloxy-naphthalen-1-yl]pyridin-2-yl]-4-pyridin-3-yl-phthalazin-1-one hydrochloride

Systemtic Name: 2-[4-[2,3-bis(hydroxymethyl)-7-methoxy-6-propan-2-yloxy-naphthalen-1-yl]pyridin-2-yl]-4-pyridin-3-yl-phthalazin-1-one hydrochloride Openeye Name: 2-[4-[2,3-bis(hydroxymethyl)-6-isopropoxy-7-methoxy-1-naphthyl]-2-pyridyl]-4-(3-pyridyl)phthalazin-1-one hydrochloride CAS Name: 2-[4-[2,3-bis(hydroxymethyl)-7-methoxy-6-propan-2-yloxy-1-naphthalenyl]-2-pyridinyl]-4-(3-pyridinyl)-1-phthalazinone hydrochloride IUPAC Name: 2-[4-[2,3-bis(hydroxymethyl)-7-methoxy-6-propan-2-yloxynaphthalen-1-yl]pyridin-2-yl]-4-pyridin-3-ylphthalazin-1-one hydrochloride Traditional Name: 2-[4-(6-isopropoxy-7-methoxy-2,3-dimethylol-1-naphthyl)-2-pyridyl]-4-(3-pyridyl)phthalazin-1-one hydrochloride Formula: C34H31ClN4O5 MolecularWeight: 611.08674

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC2=CC(=C(C(=C2C=C1OC)C3=CC(=NC=C3)N4C(=O)C5=CC=CC=C5C(=N4)C6=CN=CC=C6)CO)CO.Cl

Isomeric SMILES

CC(C)OC1=CC2=CC(=C(C(=C2C=C1OC)C3=CC(=NC=C3)N4C(=O)C5=CC=CC=C5C(=N4)C6=CN=CC=C6)CO)CO.Cl

InChI

InChI=1S/C34H30N4O5.ClH/c1-20(2)43-30-14-23-13-24(18-39)28(19-40)32(27(23)16-29(30)42-3)21-10-12-36-31(15-21)38-34(41)26-9-5-4-8-25(26)33(37-38)22-7-6-11-35-17-22;/h4-17,20,39-40H,18-19H2,1-3H3;1H