N-[(E)-[4-[(4-methylphenyl)methoxy]phenyl]methylideneamino]-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide

Systemtic Name: N-[(E)-[4-[(4-methylphenyl)methoxy]phenyl]methylideneamino]-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide Openeye Name: 3-isopropyl-4-oxo-N-[(E)-[4-(p-tolylmethoxy)phenyl]methyleneamino]phthalazine-1-carboxamide CAS Name: N-[(E)-[4-[(4-methylphenyl)methoxy]phenyl]methylideneamino]-4-oxo-3-propan-2-yl-1-phthalazinecarboxamide IUPAC Name: N-[(E)-[4-[(4-methylphenyl)methoxy]phenyl]methylideneamino]-4-oxo-3-propan-2-ylphthalazine-1-carboxamide Traditional Name: 3-isopropyl-4-keto-N-[(E)-[4-(4-methylbenzyl)oxybenzylidene]amino]phthalazine-1-carboxamide Formula: C27H26N4O3 MolecularWeight: 454.52034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC2=CC=C(C=C2)C=NNC(=O)C3=NN(C(=O)C4=CC=CC=C43)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)COC2=CC=C(C=C2)/C=N/NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C(C)C

InChI

InChI=1S/C27H26N4O3/c1-18(2)31-27(33)24-7-5-4-6-23(24)25(30-31)26(32)29-28-16-20-12-14-22(15-13-20)34-17-21-10-8-19(3)9-11-21/h4-16,18H,17H2,1-3H3,(H,29,32)/b28-16+