(4-nitrophenyl) 2-[[4-methyl-2-(pyrrolidin-2-ylcarbonylamino)pentanoyl]amino]ethanoate hydrochloride

Systemtic Name: (4-nitrophenyl) 2-[[4-methyl-2-(pyrrolidin-2-ylcarbonylamino)pentanoyl]amino]ethanoate hydrochloride Openeye Name: (4-nitrophenyl) 2-[[4-methyl-2-(pyrrolidine-2-carbonylamino)pentanoyl]amino]acetate hydrochloride CAS Name: 2-[[4-methyl-1-oxo-2-[[oxo(2-pyrrolidinyl)methyl]amino]pentyl]amino]acetic acid (4-nitrophenyl) ester hydrochloride IUPAC Name: (4-nitrophenyl) 2-[[4-methyl-2-(pyrrolidine-2-carbonylamino)pentanoyl]amino]acetate hydrochloride Traditional Name: 2-[[4-methyl-2-(prolylamino)pentanoyl]amino]acetic acid (4-nitrophenyl) ester hydrochloride Formula: C19H27ClN4O6 MolecularWeight: 442.89388

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NCC(=O)OC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)C2CCCN2.Cl

Isomeric SMILES

CC(C)CC(C(=O)NCC(=O)OC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)C2CCCN2.Cl

InChI

InChI=1S/C19H26N4O6.ClH/c1-12(2)10-16(22-19(26)15-4-3-9-20-15)18(25)21-11-17(24)29-14-7-5-13(6-8-14)23(27)28;/h5-8,12,15-16,20H,3-4,9-11H2,1-2H3,(H,21,25)(H,22,26);1H