5-[[4-[(4-methyl-1H-indol-3-yl)methyl]-1-oxidanylidene-phthalazin-2-yl]methyl]-1,2-oxazol-3-one

Systemtic Name: 5-[[4-[(4-methyl-1H-indol-3-yl)methyl]-1-oxidanylidene-phthalazin-2-yl]methyl]-1,2-oxazol-3-one Openeye Name: 5-[[4-[(4-methyl-1H-indol-3-yl)methyl]-1-oxo-phthalazin-2-yl]methyl]isoxazol-3-one CAS Name: 5-[[4-[(4-methyl-1H-indol-3-yl)methyl]-1-oxo-2-phthalazinyl]methyl]-3-isoxazolone IUPAC Name: 5-[[4-[(4-methyl-1H-indol-3-yl)methyl]-1-oxophthalazin-2-yl]methyl]-1,2-oxazol-3-one Traditional Name: 5-[[1-keto-4-[(4-methyl-1H-indol-3-yl)methyl]phthalazin-2-yl]methyl]-4-isoxazolin-3-one Formula: C22H18N4O3 MolecularWeight: 386.40332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)NC=C2CC3=NN(C(=O)C4=CC=CC=C43)CC5=CC(=O)NO5

Isomeric SMILES

CC1=C2C(=CC=C1)NC=C2CC3=NN(C(=O)C4=CC=CC=C43)CC5=CC(=O)NO5

InChI

InChI=1S/C22H18N4O3/c1-13-5-4-8-18-21(13)14(11-23-18)9-19-16-6-2-3-7-17(16)22(28)26(24-19)12-15-10-20(27)25-29-15/h2-8,10-11,23H,9,12H2,1H3,(H,25,27)