2-[(2S,3S)-2-azanyl-3-methyl-pentanoyl]-N-(5-nitropyridin-2-yl)pyrazolidine-1-carboxamide hydrochloride

Systemtic Name: 2-[(2S,3S)-2-azanyl-3-methyl-pentanoyl]-N-(5-nitropyridin-2-yl)pyrazolidine-1-carboxamide hydrochloride Openeye Name: 2-[(2S,3S)-2-amino-3-methyl-pentanoyl]-N-(5-nitro-2-pyridyl)pyrazolidine-1-carboxamide hydrochloride CAS Name: 2-[(2S,3S)-2-amino-3-methyl-1-oxopentyl]-N-(5-nitro-2-pyridinyl)-1-pyrazolidinecarboxamide hydrochloride IUPAC Name: 2-[(2S,3S)-2-amino-3-methylpentanoyl]-N-(5-nitropyridin-2-yl)pyrazolidine-1-carboxamide hydrochloride Traditional Name: 2-[(2S,3S)-2-amino-3-methyl-pentanoyl]-N-(5-nitro-2-pyridyl)pyrazolidine-1-carboxamide hydrochloride Formula: C15H23ClN6O4 MolecularWeight: 386.83392

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N1CCCN1C(=O)NC2=NC=C(C=C2)[N+](=O)[O-])N.Cl

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)N1CCCN1C(=O)NC2=NC=C(C=C2)[N+](=O)[O-])N.Cl

InChI

InChI=1S/C15H22N6O4.ClH/c1-3-10(2)13(16)14(22)19-7-4-8-20(19)15(23)18-12-6-5-11(9-17-12)21(24)25;/h5-6,9-10,13H,3-4,7-8,16H2,1-2H3,(H,17,18,23);1H/t10-,13-;/m0./s1