N-[(E)-[5-(4-nitrophenyl)furan-2-yl]methylideneamino]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide

Systemtic Name: N-[(E)-[5-(4-nitrophenyl)furan-2-yl]methylideneamino]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-N-[(E)-[5-(4-nitrophenyl)-2-furyl]methyleneamino]-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(E)-[5-(4-nitrophenyl)-2-furanyl]methylideneamino]-4-oxo-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-N-[(E)-[5-(4-nitrophenyl)furan-2-yl]methylideneamino]-4-oxophthalazine-1-carboxamide Traditional Name: 3-benzyl-4-keto-N-[(E)-[5-(4-nitrophenyl)-2-furyl]methyleneamino]phthalazine-1-carboxamide Formula: C27H19N5O5 MolecularWeight: 493.47026

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)NN=CC4=CC=C(O4)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)N/N=C/C4=CC=C(O4)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C27H19N5O5/c33-26(29-28-16-21-14-15-24(37-21)19-10-12-20(13-11-19)32(35)36)25-22-8-4-5-9-23(22)27(34)31(30-25)17-18-6-2-1-3-7-18/h1-16H,17H2,(H,29,33)/b28-16+