[5-chloranyl-1-(phenylmethyl)-1,2,3-triazol-4-yl]-(4-methoxy-3-methyl-2-oxidanyl-phenyl)methanone

Systemtic Name: [5-chloranyl-1-(phenylmethyl)-1,2,3-triazol-4-yl]-(4-methoxy-3-methyl-2-oxidanyl-phenyl)methanone Openeye Name: (1-benzyl-5-chloro-triazol-4-yl)-(2-hydroxy-4-methoxy-3-methyl-phenyl)methanone CAS Name: [5-chloro-1-(phenylmethyl)-4-triazolyl]-(2-hydroxy-4-methoxy-3-methylphenyl)methanone IUPAC Name: (1-benzyl-5-chlorotriazol-4-yl)-(2-hydroxy-4-methoxy-3-methylphenyl)methanone Traditional Name: (1-benzyl-5-chloro-triazol-4-yl)-(2-hydroxy-4-methoxy-3-methyl-phenyl)methanone Formula: C18H16ClN3O3 MolecularWeight: 357.79094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1O)C(=O)C2=C(N(N=N2)CC3=CC=CC=C3)Cl)OC

Isomeric SMILES

CC1=C(C=CC(=C1O)C(=O)C2=C(N(N=N2)CC3=CC=CC=C3)Cl)OC

InChI

InChI=1S/C18H16ClN3O3/c1-11-14(25-2)9-8-13(16(11)23)17(24)15-18(19)22(21-20-15)10-12-6-4-3-5-7-12/h3-9,23H,10H2,1-2H3