methyl 6-[2-[(5-methyl-2-phenyl-1,2,3-triazol-4-yl)carbonyl]pyrazolidin-1-yl]-6-oxidanylidene-hexanoate

Systemtic Name: methyl 6-[2-[(5-methyl-2-phenyl-1,2,3-triazol-4-yl)carbonyl]pyrazolidin-1-yl]-6-oxidanylidene-hexanoate Openeye Name: methyl 6-[2-(5-methyl-2-phenyl-triazole-4-carbonyl)pyrazolidin-1-yl]-6-oxo-hexanoate CAS Name: 6-[2-[(5-methyl-2-phenyl-4-triazolyl)-oxomethyl]-1-pyrazolidinyl]-6-oxohexanoic acid methyl ester IUPAC Name: methyl 6-[2-(5-methyl-2-phenyltriazole-4-carbonyl)pyrazolidin-1-yl]-6-oxohexanoate Traditional Name: 6-keto-6-[2-(5-methyl-2-phenyl-triazole-4-carbonyl)pyrazolidin-1-yl]hexanoic acid methyl ester Formula: C20H25N5O4 MolecularWeight: 399.4436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(N=C1C(=O)N2CCCN2C(=O)CCCCC(=O)OC)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(N=C1C(=O)N2CCCN2C(=O)CCCCC(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C20H25N5O4/c1-15-19(22-25(21-15)16-9-4-3-5-10-16)20(28)24-14-8-13-23(24)17(26)11-6-7-12-18(27)29-2/h3-5,9-10H,6-8,11-14H2,1-2H3