2-(4-nitrophenyl)-4-thiophen-2-yl-phthalazin-1-one

Systemtic Name: 2-(4-nitrophenyl)-4-thiophen-2-yl-phthalazin-1-one Openeye Name: 2-(4-nitrophenyl)-4-(2-thienyl)phthalazin-1-one CAS Name: 2-(4-nitrophenyl)-4-thiophen-2-yl-1-phthalazinone IUPAC Name: 2-(4-nitrophenyl)-4-thiophen-2-ylphthalazin-1-one Traditional Name: 2-(4-nitrophenyl)-4-(2-thienyl)phthalazin-1-one Formula: C18H11N3O3S MolecularWeight: 349.36324

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN(C2=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN(C2=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CS4

InChI

InChI=1S/C18H11N3O3S/c22-18-15-5-2-1-4-14(15)17(16-6-3-11-25-16)19-20(18)12-7-9-13(10-8-12)21(23)24/h1-11H