[2-[4-(1,3-dihydrobenzotriazol-2-yl)-2-methyl-phenyl]-2-oxidanyl-ethyl] prop-2-enoate

Systemtic Name: [2-[4-(1,3-dihydrobenzotriazol-2-yl)-2-methyl-phenyl]-2-oxidanyl-ethyl] prop-2-enoate Openeye Name: [2-[4-(1,3-dihydrobenzotriazol-2-yl)-2-methyl-phenyl]-2-hydroxy-ethyl] prop-2-enoate CAS Name: 2-propenoic acid [2-[4-(1,3-dihydrobenzotriazol-2-yl)-2-methylphenyl]-2-hydroxyethyl] ester IUPAC Name: [2-[4-(1,3-dihydrobenzotriazol-2-yl)-2-methylphenyl]-2-hydroxyethyl] prop-2-enoate Traditional Name: acrylic acid [2-[4-(1,3-dihydrobenzotriazol-2-yl)-2-methyl-phenyl]-2-hydroxy-ethyl] ester Formula: C18H19N3O3 MolecularWeight: 325.36176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2NC3=CC=CC=C3N2)C(COC(=O)C=C)O

Isomeric SMILES

CC1=C(C=CC(=C1)N2NC3=CC=CC=C3N2)C(COC(=O)C=C)O

InChI

InChI=1S/C18H19N3O3/c1-3-18(23)24-11-17(22)14-9-8-13(10-12(14)2)21-19-15-6-4-5-7-16(15)20-21/h3-10,17,19-20,22H,1,11H2,2H3