3-oxidanyl-2-[1-(pyridin-4-ylmethyl)pyrrol-2-yl]-3-(2H-1,2,3,4-tetrazol-5-yl)prop-1-en-1-one

Systemtic Name: 3-oxidanyl-2-[1-(pyridin-4-ylmethyl)pyrrol-2-yl]-3-(2H-1,2,3,4-tetrazol-5-yl)prop-1-en-1-one Openeye Name: 3-hydroxy-2-[1-(4-pyridylmethyl)pyrrol-2-yl]-3-(2H-tetrazol-5-yl)prop-1-en-1-one CAS Name: 3-hydroxy-2-[1-(pyridin-4-ylmethyl)-2-pyrrolyl]-3-(2H-tetrazol-5-yl)-1-propen-1-one IUPAC Name: 3-hydroxy-2-[1-(pyridin-4-ylmethyl)pyrrol-2-yl]-3-(2H-tetrazol-5-yl)prop-1-en-1-one Traditional Name: 3-hydroxy-2-[1-(4-pyridylmethyl)pyrrol-2-yl]-3-(2H-tetrazol-5-yl)prop-1-en-1-one Formula: C14H12N6O2 MolecularWeight: 296.28408

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C(=C1)C(=C=O)C(C2=NNN=N2)O)CC3=CC=NC=C3

Isomeric SMILES

C1=CN(C(=C1)C(=C=O)C(C2=NNN=N2)O)CC3=CC=NC=C3

InChI

InChI=1S/C14H12N6O2/c21-9-11(13(22)14-16-18-19-17-14)12-2-1-7-20(12)8-10-3-5-15-6-4-10/h1-7,13,22H,8H2,(H,16,17,18,19)