9H-fluoren-9-ylmethyl 4-(3-oxidanylidene-5-phenyl-1H-1,2,4-triazol-2-yl)piperidine-1-carboxylate

Systemtic Name: 9H-fluoren-9-ylmethyl 4-(3-oxidanylidene-5-phenyl-1H-1,2,4-triazol-2-yl)piperidine-1-carboxylate Openeye Name: 9H-fluoren-9-ylmethyl 4-(3-oxo-5-phenyl-1H-1,2,4-triazol-2-yl)piperidine-1-carboxylate CAS Name: 4-(3-oxo-5-phenyl-1H-1,2,4-triazol-2-yl)-1-piperidinecarboxylic acid 9H-fluoren-9-ylmethyl ester IUPAC Name: 9H-fluoren-9-ylmethyl 4-(3-oxo-5-phenyl-1H-1,2,4-triazol-2-yl)piperidine-1-carboxylate Traditional Name: 4-(3-keto-5-phenyl-1H-1,2,4-triazol-2-yl)piperidine-1-carboxylic acid 9H-fluoren-9-ylmethyl ester Formula: C28H26N4O3 MolecularWeight: 466.53104

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C(=O)N=C(N2)C3=CC=CC=C3)C(=O)OCC4C5=CC=CC=C5C6=CC=CC=C46

Isomeric SMILES

C1CN(CCC1N2C(=O)N=C(N2)C3=CC=CC=C3)C(=O)OCC4C5=CC=CC=C5C6=CC=CC=C46

InChI

InChI=1S/C28H26N4O3/c33-27-29-26(19-8-2-1-3-9-19)30-32(27)20-14-16-31(17-15-20)28(34)35-18-25-23-12-6-4-10-21(23)22-11-5-7-13-24(22)25/h1-13,20,25H,14-18H2,(H,29,30,33)