methyl 3-[[4-(4-ethanoylpiperazin-1-yl)-4-oxidanylidene-butanoyl]amino]-4-methyl-benzoate

Systemtic Name: methyl 3-[[4-(4-ethanoylpiperazin-1-yl)-4-oxidanylidene-butanoyl]amino]-4-methyl-benzoate Openeye Name: methyl 3-[[4-(4-acetylpiperazin-1-yl)-4-oxo-butanoyl]amino]-4-methyl-benzoate CAS Name: 3-[[4-(4-acetyl-1-piperazinyl)-1,4-dioxobutyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[4-(4-acetylpiperazin-1-yl)-4-oxobutanoyl]amino]-4-methylbenzoate Traditional Name: 3-[[4-(4-acetylpiperazino)-4-keto-butanoyl]amino]-4-methyl-benzoic acid methyl ester Formula: C19H25N3O5 MolecularWeight: 375.4189

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CCC(=O)N2CCN(CC2)C(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CCC(=O)N2CCN(CC2)C(=O)C

InChI

InChI=1S/C19H25N3O5/c1-13-4-5-15(19(26)27-3)12-16(13)20-17(24)6-7-18(25)22-10-8-21(9-11-22)14(2)23/h4-5,12H,6-11H2,1-3H3,(H,20,24)