ethyl 3-[[4-[[(3S)-1-butyl-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]phenyl]carbonylamino]benzoate

Systemtic Name: ethyl 3-[[4-[[(3S)-1-butyl-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]phenyl]carbonylamino]benzoate Openeye Name: ethyl 3-[[4-[[(3S)-1-butyl-5-oxo-pyrrolidine-3-carbonyl]amino]benzoyl]amino]benzoate CAS Name: 3-[[[4-[[[(3S)-1-butyl-5-oxo-3-pyrrolidinyl]-oxomethyl]amino]phenyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[4-[[(3S)-1-butyl-5-oxopyrrolidine-3-carbonyl]amino]benzoyl]amino]benzoate Traditional Name: 3-[[4-[[(3S)-1-butyl-5-keto-pyrrolidine-3-carbonyl]amino]benzoyl]amino]benzoic acid ethyl ester Formula: C25H29N3O5 MolecularWeight: 451.51486

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CC(CC1=O)C(=O)NC2=CC=C(C=C2)C(=O)NC3=CC=CC(=C3)C(=O)OCC

Isomeric SMILES

CCCCN1C[C@H](CC1=O)C(=O)NC2=CC=C(C=C2)C(=O)NC3=CC=CC(=C3)C(=O)OCC

InChI

InChI=1S/C25H29N3O5/c1-3-5-13-28-16-19(15-22(28)29)24(31)26-20-11-9-17(10-12-20)23(30)27-21-8-6-7-18(14-21)25(32)33-4-2/h6-12,14,19H,3-5,13,15-16H2,1-2H3,(H,26,31)(H,27,30)/t19-/m0/s1