5-methyl-1-(4-nitrophenyl)-N-[1-(3-propan-2-yloxyphenyl)ethyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: 5-methyl-1-(4-nitrophenyl)-N-[1-(3-propan-2-yloxyphenyl)ethyl]-1,2,3-triazole-4-carboxamide Openeye Name: N-[1-(3-isopropoxyphenyl)ethyl]-5-methyl-1-(4-nitrophenyl)triazole-4-carboxamide CAS Name: 5-methyl-1-(4-nitrophenyl)-N-[1-(3-propan-2-yloxyphenyl)ethyl]-4-triazolecarboxamide IUPAC Name: 5-methyl-1-(4-nitrophenyl)-N-[1-(3-propan-2-yloxyphenyl)ethyl]triazole-4-carboxamide Traditional Name: N-[1-(3-isopropoxyphenyl)ethyl]-5-methyl-1-(4-nitrophenyl)triazole-4-carboxamide Formula: C21H23N5O4 MolecularWeight: 409.43842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=NN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)NC(C)C3=CC(=CC=C3)OC(C)C

Isomeric SMILES

CC1=C(N=NN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)NC(C)C3=CC(=CC=C3)OC(C)C

InChI

InChI=1S/C21H23N5O4/c1-13(2)30-19-7-5-6-16(12-19)14(3)22-21(27)20-15(4)25(24-23-20)17-8-10-18(11-9-17)26(28)29/h5-14H,1-4H3,(H,22,27)