methyl 3-[[4-(2,3-dihydro-1H-inden-5-yl)-4-oxidanylidene-butanoyl]amino]benzoate

Systemtic Name: methyl 3-[[4-(2,3-dihydro-1H-inden-5-yl)-4-oxidanylidene-butanoyl]amino]benzoate Openeye Name: methyl 3-[(4-indan-5-yl-4-oxo-butanoyl)amino]benzoate CAS Name: 3-[[4-(2,3-dihydro-1H-inden-5-yl)-1,4-dioxobutyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[4-(2,3-dihydro-1H-inden-5-yl)-4-oxobutanoyl]amino]benzoate Traditional Name: 3-[(4-indan-5-yl-4-keto-butanoyl)amino]benzoic acid methyl ester Formula: C21H21NO4 MolecularWeight: 351.39574

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NC(=O)CCC(=O)C2=CC3=C(CCC3)C=C2

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NC(=O)CCC(=O)C2=CC3=C(CCC3)C=C2

InChI

InChI=1S/C21H21NO4/c1-26-21(25)17-6-3-7-18(13-17)22-20(24)11-10-19(23)16-9-8-14-4-2-5-15(14)12-16/h3,6-9,12-13H,2,4-5,10-11H2,1H3,(H,22,24)