ethyl (E)-3-[2-(3-butyl-4-oxidanylidene-phthalazin-1-yl)carbonylhydrazinyl]-2-cyano-prop-2-enoate

Systemtic Name: ethyl (E)-3-[2-(3-butyl-4-oxidanylidene-phthalazin-1-yl)carbonylhydrazinyl]-2-cyano-prop-2-enoate Openeye Name: ethyl (E)-3-[2-(3-butyl-4-oxo-phthalazine-1-carbonyl)hydrazino]-2-cyano-prop-2-enoate CAS Name: (E)-3-[[(3-butyl-4-oxo-1-phthalazinyl)-oxomethyl]hydrazo]-2-cyano-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[2-(3-butyl-4-oxophthalazine-1-carbonyl)hydrazinyl]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[N'-(3-butyl-4-keto-phthalazine-1-carbonyl)hydrazino]-2-cyano-acrylic acid ethyl ester Formula: C19H21N5O4 MolecularWeight: 383.40114

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC=C(C#N)C(=O)OCC

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN/C=C(\C#N)/C(=O)OCC

InChI

InChI=1S/C19H21N5O4/c1-3-5-10-24-18(26)15-9-7-6-8-14(15)16(23-24)17(25)22-21-12-13(11-20)19(27)28-4-2/h6-9,12,21H,3-5,10H2,1-2H3,(H,22,25)/b13-12+