ethyl (E)-3-[4-[(4-oxidanylidene-3-propyl-phthalazin-1-yl)carbonylamino]phenyl]prop-2-enoate

Systemtic Name: ethyl (E)-3-[4-[(4-oxidanylidene-3-propyl-phthalazin-1-yl)carbonylamino]phenyl]prop-2-enoate Openeye Name: ethyl (E)-3-[4-[(4-oxo-3-propyl-phthalazine-1-carbonyl)amino]phenyl]prop-2-enoate CAS Name: (E)-3-[4-[[oxo-(4-oxo-3-propyl-1-phthalazinyl)methyl]amino]phenyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[4-[(4-oxo-3-propylphthalazine-1-carbonyl)amino]phenyl]prop-2-enoate Traditional Name: (E)-3-[4-[(4-keto-3-propyl-phthalazine-1-carbonyl)amino]phenyl]acrylic acid ethyl ester Formula: C23H23N3O4 MolecularWeight: 405.44642

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=C(C=C3)C=CC(=O)OCC

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=C(C=C3)/C=C/C(=O)OCC

InChI

InChI=1S/C23H23N3O4/c1-3-15-26-23(29)19-8-6-5-7-18(19)21(25-26)22(28)24-17-12-9-16(10-13-17)11-14-20(27)30-4-2/h5-14H,3-4,15H2,1-2H3,(H,24,28)/b14-11+