2,3-dihydro-1H-inden-2-yl 3-(5-methyl-3-oxidanylidene-4-phenyl-1,2,4-triazolidin-1-yl)propanoate

Systemtic Name: 2,3-dihydro-1H-inden-2-yl 3-(5-methyl-3-oxidanylidene-4-phenyl-1,2,4-triazolidin-1-yl)propanoate Openeye Name: indan-2-yl 3-(5-methyl-3-oxo-4-phenyl-1,2,4-triazolidin-1-yl)propanoate CAS Name: 3-(5-methyl-3-oxo-4-phenyl-1,2,4-triazolidin-1-yl)propanoic acid 2,3-dihydro-1H-inden-2-yl ester IUPAC Name: 2,3-dihydro-1H-inden-2-yl 3-(5-methyl-3-oxo-4-phenyl-1,2,4-triazolidin-1-yl)propanoate Traditional Name: 3-(3-keto-5-methyl-4-phenyl-1,2,4-triazolidin-1-yl)propionic acid indan-2-yl ester Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

CC1N(NC(=O)N1C2=CC=CC=C2)CCC(=O)OC3CC4=CC=CC=C4C3

Isomeric SMILES

CC1N(NC(=O)N1C2=CC=CC=C2)CCC(=O)OC3CC4=CC=CC=C4C3

InChI

InChI=1S/C21H23N3O3/c1-15-23(22-21(26)24(15)18-9-3-2-4-10-18)12-11-20(25)27-19-13-16-7-5-6-8-17(16)14-19/h2-10,15,19H,11-14H2,1H3,(H,22,26)