ethyl 3-[[2-[4-(methylamino)-4-oxidanylidene-butanoyl]pyrazolidin-1-yl]carbonylamino]benzoate

Systemtic Name: ethyl 3-[[2-[4-(methylamino)-4-oxidanylidene-butanoyl]pyrazolidin-1-yl]carbonylamino]benzoate Openeye Name: ethyl 3-[[2-[4-(methylamino)-4-oxo-butanoyl]pyrazolidine-1-carbonyl]amino]benzoate CAS Name: 3-[[[2-[4-(methylamino)-1,4-dioxobutyl]-1-pyrazolidinyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[2-[4-(methylamino)-4-oxobutanoyl]pyrazolidine-1-carbonyl]amino]benzoate Traditional Name: 3-[[2-[4-keto-4-(methylamino)butanoyl]pyrazolidine-1-carbonyl]amino]benzoic acid ethyl ester Formula: C18H24N4O5 MolecularWeight: 376.40696

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)N2CCCN2C(=O)CCC(=O)NC

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)N2CCCN2C(=O)CCC(=O)NC

InChI

InChI=1S/C18H24N4O5/c1-3-27-17(25)13-6-4-7-14(12-13)20-18(26)22-11-5-10-21(22)16(24)9-8-15(23)19-2/h4,6-7,12H,3,5,8-11H2,1-2H3,(H,19,23)(H,20,26)