4-[[4-(4-prop-2-ynoxyphenyl)-2,3-dihydrophthalazin-1-yl]imino]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[[4-(4-prop-2-ynoxyphenyl)-2,3-dihydrophthalazin-1-yl]imino]cyclohexa-2,5-dien-1-one Openeye Name: 4-[[4-(4-prop-2-ynoxyphenyl)-2,3-dihydrophthalazin-1-yl]imino]cyclohexa-2,5-dien-1-one CAS Name: 4-[[4-(4-prop-2-ynoxyphenyl)-2,3-dihydrophthalazin-1-yl]imino]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[[4-(4-prop-2-ynoxyphenyl)-2,3-dihydrophthalazin-1-yl]imino]cyclohexa-2,5-dien-1-one Traditional Name: 4-[[4-(4-propargyloxyphenyl)-2,3-dihydrophthalazin-1-yl]imino]cyclohexa-2,5-dien-1-one Formula: C23H17N3O2 MolecularWeight: 367.39998

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC1=CC=C(C=C1)C2=C3C=CC=CC3=C(NN2)N=C4C=CC(=O)C=C4

Isomeric SMILES

C#CCOC1=CC=C(C=C1)C2=C3C=CC=CC3=C(NN2)N=C4C=CC(=O)C=C4

InChI

InChI=1S/C23H17N3O2/c1-2-15-28-19-13-7-16(8-14-19)22-20-5-3-4-6-21(20)23(26-25-22)24-17-9-11-18(27)12-10-17/h1,3-14,25-26H,15H2