5-azanyl-1-(2-hydroxyethyl)-3-(naphthalen-1-ylmethyl)pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-1-(2-hydroxyethyl)-3-(naphthalen-1-ylmethyl)pyrazole-4-carbonitrile Openeye Name: 5-amino-1-(2-hydroxyethyl)-3-(1-naphthylmethyl)pyrazole-4-carbonitrile CAS Name: 5-amino-1-(2-hydroxyethyl)-3-(1-naphthalenylmethyl)-4-pyrazolecarbonitrile IUPAC Name: 5-amino-1-(2-hydroxyethyl)-3-(naphthalen-1-ylmethyl)pyrazole-4-carbonitrile Traditional Name: 5-amino-1-(2-hydroxyethyl)-3-(1-naphthylmethyl)pyrazole-4-carbonitrile Formula: C17H16N4O MolecularWeight: 292.33514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CC3=NN(C(=C3C#N)N)CCO

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CC3=NN(C(=C3C#N)N)CCO

InChI

InChI=1S/C17H16N4O/c18-11-15-16(20-21(8-9-22)17(15)19)10-13-6-3-5-12-4-1-2-7-14(12)13/h1-7,22H,8-10,19H2