3-azanyl-1-[5-[[2,5-bis(chloranyl)phenoxy]methyl]furan-2-yl]carbonyl-pyrazole-4-carbonitrile

Systemtic Name: 3-azanyl-1-[5-[[2,5-bis(chloranyl)phenoxy]methyl]furan-2-yl]carbonyl-pyrazole-4-carbonitrile Openeye Name: 3-amino-1-[5-[(2,5-dichlorophenoxy)methyl]furan-2-carbonyl]pyrazole-4-carbonitrile CAS Name: 3-amino-1-[[5-[(2,5-dichlorophenoxy)methyl]-2-furanyl]-oxomethyl]-4-pyrazolecarbonitrile IUPAC Name: 3-amino-1-[5-[(2,5-dichlorophenoxy)methyl]furan-2-carbonyl]pyrazole-4-carbonitrile Traditional Name: 3-amino-1-[5-[(2,5-dichlorophenoxy)methyl]-2-furoyl]pyrazole-4-carbonitrile Formula: C16H10Cl2N4O3 MolecularWeight: 377.1816

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)OCC2=CC=C(O2)C(=O)N3C=C(C(=N3)N)C#N)Cl

Isomeric SMILES

C1=CC(=C(C=C1Cl)OCC2=CC=C(O2)C(=O)N3C=C(C(=N3)N)C#N)Cl

InChI

InChI=1S/C16H10Cl2N4O3/c17-10-1-3-12(18)14(5-10)24-8-11-2-4-13(25-11)16(23)22-7-9(6-19)15(20)21-22/h1-5,7H,8H2,(H2,20,21)