2-butyl-6,7-dimethoxy-4-[4-(7-methoxynaphthalen-1-yl)piperazin-1-yl]phthalazin-1-one

Systemtic Name: 2-butyl-6,7-dimethoxy-4-[4-(7-methoxynaphthalen-1-yl)piperazin-1-yl]phthalazin-1-one Openeye Name: 2-butyl-6,7-dimethoxy-4-[4-(7-methoxy-1-naphthyl)piperazin-1-yl]phthalazin-1-one CAS Name: 2-butyl-6,7-dimethoxy-4-[4-(7-methoxy-1-naphthalenyl)-1-piperazinyl]-1-phthalazinone IUPAC Name: 2-butyl-6,7-dimethoxy-4-[4-(7-methoxynaphthalen-1-yl)piperazin-1-yl]phthalazin-1-one Traditional Name: 2-butyl-6,7-dimethoxy-4-[4-(7-methoxy-1-naphthyl)piperazino]phthalazin-1-one Formula: C29H34N4O4 MolecularWeight: 502.60466

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC(=C(C=C2C(=N1)N3CCN(CC3)C4=CC=CC5=C4C=C(C=C5)OC)OC)OC

Isomeric SMILES

CCCCN1C(=O)C2=CC(=C(C=C2C(=N1)N3CCN(CC3)C4=CC=CC5=C4C=C(C=C5)OC)OC)OC

InChI

InChI=1S/C29H34N4O4/c1-5-6-12-33-29(34)24-19-27(37-4)26(36-3)18-23(24)28(30-33)32-15-13-31(14-16-32)25-9-7-8-20-10-11-21(35-2)17-22(20)25/h7-11,17-19H,5-6,12-16H2,1-4H3