ethyl 4-[[5-(3-methoxyphenyl)-1-phenyl-1,2,4-triazol-3-yl]carbonyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[[5-(3-methoxyphenyl)-1-phenyl-1,2,4-triazol-3-yl]carbonyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[5-(3-methoxyphenyl)-1-phenyl-1,2,4-triazole-3-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[5-(3-methoxyphenyl)-1-phenyl-1,2,4-triazol-3-yl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[5-(3-methoxyphenyl)-1-phenyl-1,2,4-triazole-3-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[5-(3-methoxyphenyl)-1-phenyl-1,2,4-triazole-3-carbonyl]piperazine-1-carboxylic acid ethyl ester Formula: C23H25N5O4 MolecularWeight: 435.4757

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=NN(C(=N2)C3=CC(=CC=C3)OC)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=NN(C(=N2)C3=CC(=CC=C3)OC)C4=CC=CC=C4

InChI

InChI=1S/C23H25N5O4/c1-3-32-23(30)27-14-12-26(13-15-27)22(29)20-24-21(17-8-7-11-19(16-17)31-2)28(25-20)18-9-5-4-6-10-18/h4-11,16H,3,12-15H2,1-2H3