4-chloranyl-2-(2-methoxyphenyl)-2-(1,2,4-triazol-1-ylmethyl)pent-4-enenitrile

Systemtic Name: 4-chloranyl-2-(2-methoxyphenyl)-2-(1,2,4-triazol-1-ylmethyl)pent-4-enenitrile Openeye Name: 4-chloro-2-(2-methoxyphenyl)-2-(1,2,4-triazol-1-ylmethyl)pent-4-enenitrile CAS Name: 4-chloro-2-(2-methoxyphenyl)-2-(1,2,4-triazol-1-ylmethyl)-4-pentenenitrile IUPAC Name: 4-chloro-2-(2-methoxyphenyl)-2-(1,2,4-triazol-1-ylmethyl)pent-4-enenitrile Traditional Name: 4-chloro-2-(2-methoxyphenyl)-2-(1,2,4-triazol-1-ylmethyl)pent-4-enenitrile Formula: C15H15ClN4O MolecularWeight: 302.7588

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(CC(=C)Cl)(CN2C=NC=N2)C#N

Isomeric SMILES

COC1=CC=CC=C1C(CC(=C)Cl)(CN2C=NC=N2)C#N

InChI

InChI=1S/C15H15ClN4O/c1-12(16)7-15(8-17,9-20-11-18-10-19-20)13-5-3-4-6-14(13)21-2/h3-6,10-11H,1,7,9H2,2H3