methylaminomethyl 3-propan-2-ylbenzotriazole-5-carboxylate

Systemtic Name: methylaminomethyl 3-propan-2-ylbenzotriazole-5-carboxylate Openeye Name: methylaminomethyl 3-isopropylbenzotriazole-5-carboxylate CAS Name: 3-propan-2-yl-5-benzotriazolecarboxylic acid methylaminomethyl ester IUPAC Name: methylaminomethyl 3-propan-2-ylbenzotriazole-5-carboxylate Traditional Name: 3-isopropylbenzotriazole-5-carboxylic acid methylaminomethyl ester Formula: C12H16N4O2 MolecularWeight: 248.28104

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C=CC(=C2)C(=O)OCNC)N=N1

Isomeric SMILES

CC(C)N1C2=C(C=CC(=C2)C(=O)OCNC)N=N1

InChI

InChI=1S/C12H16N4O2/c1-8(2)16-11-6-9(12(17)18-7-13-3)4-5-10(11)14-15-16/h4-6,8,13H,7H2,1-3H3