4-(3-cyclopentyloxy-4-methoxy-phenyl)-2-phenacyl-phthalazin-1-one

Systemtic Name: 4-(3-cyclopentyloxy-4-methoxy-phenyl)-2-phenacyl-phthalazin-1-one Openeye Name: 4-[3-(cyclopentoxy)-4-methoxy-phenyl]-2-phenacyl-phthalazin-1-one CAS Name: 4-(3-cyclopentyloxy-4-methoxyphenyl)-2-phenacyl-1-phthalazinone IUPAC Name: 4-(3-cyclopentyloxy-4-methoxyphenyl)-2-phenacylphthalazin-1-one Traditional Name: 4-[3-(cyclopentoxy)-4-methoxy-phenyl]-2-phenacyl-phthalazin-1-one Formula: C28H26N2O4 MolecularWeight: 454.51704

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)CC(=O)C4=CC=CC=C4)OC5CCCC5

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)CC(=O)C4=CC=CC=C4)OC5CCCC5

InChI

InChI=1S/C28H26N2O4/c1-33-25-16-15-20(17-26(25)34-21-11-5-6-12-21)27-22-13-7-8-14-23(22)28(32)30(29-27)18-24(31)19-9-3-2-4-10-19/h2-4,7-10,13-17,21H,5-6,11-12,18H2,1H3