methyl 2-[[1-(2-methylpropyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]-5-morpholin-4-yl-benzoate

Systemtic Name: methyl 2-[[1-(2-methylpropyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]-5-morpholin-4-yl-benzoate Openeye Name: methyl 2-[(1-isobutyl-5-oxo-pyrrolidine-3-carbonyl)amino]-5-morpholino-benzoate CAS Name: 2-[[[1-(2-methylpropyl)-5-oxo-3-pyrrolidinyl]-oxomethyl]amino]-5-(4-morpholinyl)benzoic acid methyl ester IUPAC Name: methyl 2-[[1-(2-methylpropyl)-5-oxopyrrolidine-3-carbonyl]amino]-5-morpholin-4-ylbenzoate Traditional Name: 2-[(1-isobutyl-5-keto-pyrrolidine-3-carbonyl)amino]-5-morpholino-benzoic acid methyl ester Formula: C21H29N3O5 MolecularWeight: 403.47206

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CC(CC1=O)C(=O)NC2=C(C=C(C=C2)N3CCOCC3)C(=O)OC

Isomeric SMILES

CC(C)CN1CC(CC1=O)C(=O)NC2=C(C=C(C=C2)N3CCOCC3)C(=O)OC

InChI

InChI=1S/C21H29N3O5/c1-14(2)12-24-13-15(10-19(24)25)20(26)22-18-5-4-16(11-17(18)21(27)28-3)23-6-8-29-9-7-23/h4-5,11,14-15H,6-10,12-13H2,1-3H3,(H,22,26)