5-azanyl-3-[(Z)-1-cyano-2-(7-methoxy-1,3-benzodioxol-5-yl)ethenyl]-1-(2-hydroxyethyl)pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-3-[(Z)-1-cyano-2-(7-methoxy-1,3-benzodioxol-5-yl)ethenyl]-1-(2-hydroxyethyl)pyrazole-4-carbonitrile Openeye Name: 5-amino-3-[(Z)-1-cyano-2-(7-methoxy-1,3-benzodioxol-5-yl)vinyl]-1-(2-hydroxyethyl)pyrazole-4-carbonitrile CAS Name: 5-amino-3-[(Z)-1-cyano-2-(7-methoxy-1,3-benzodioxol-5-yl)ethenyl]-1-(2-hydroxyethyl)-4-pyrazolecarbonitrile IUPAC Name: 5-amino-3-[(Z)-1-cyano-2-(7-methoxy-1,3-benzodioxol-5-yl)ethenyl]-1-(2-hydroxyethyl)pyrazole-4-carbonitrile Traditional Name: 5-amino-3-[(Z)-1-cyano-2-(7-methoxy-1,3-benzodioxol-5-yl)vinyl]-1-(2-hydroxyethyl)pyrazole-4-carbonitrile Formula: C17H15N5O4 MolecularWeight: 353.3321

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1OCO2)C=C(C#N)C3=NN(C(=C3C#N)N)CCO

Isomeric SMILES

COC1=CC(=CC2=C1OCO2)/C=C(\C#N)/C3=NN(C(=C3C#N)N)CCO

InChI

InChI=1S/C17H15N5O4/c1-24-13-5-10(6-14-16(13)26-9-25-14)4-11(7-18)15-12(8-19)17(20)22(21-15)2-3-23/h4-6,23H,2-3,9,20H2,1H3/b11-4+