N-(3-ethynylphenyl)-1-[(4-methylphenyl)methyl]-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: N-(3-ethynylphenyl)-1-[(4-methylphenyl)methyl]-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: N-(3-ethynylphenyl)-5-oxo-1-(p-tolylmethyl)pyrrolidine-3-carboxamide CAS Name: N-(3-ethynylphenyl)-1-[(4-methylphenyl)methyl]-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: N-(3-ethynylphenyl)-1-[(4-methylphenyl)methyl]-5-oxopyrrolidine-3-carboxamide Traditional Name: N-(3-ethynylphenyl)-5-keto-1-(4-methylbenzyl)pyrrolidine-3-carboxamide Formula: C21H20N2O2 MolecularWeight: 332.3957

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CC(CC2=O)C(=O)NC3=CC=CC(=C3)C#C

Isomeric SMILES

CC1=CC=C(C=C1)CN2CC(CC2=O)C(=O)NC3=CC=CC(=C3)C#C

InChI

InChI=1S/C21H20N2O2/c1-3-16-5-4-6-19(11-16)22-21(25)18-12-20(24)23(14-18)13-17-9-7-15(2)8-10-17/h1,4-11,18H,12-14H2,2H3,(H,22,25)