1-[2-[(5-chloranylpyridin-2-yl)amino]-2-oxidanylidene-ethyl]-4-nitro-N-(1-propan-2-ylpiperidin-4-yl)pyrrole-2-carboxamide

Systemtic Name: 1-[2-[(5-chloranylpyridin-2-yl)amino]-2-oxidanylidene-ethyl]-4-nitro-N-(1-propan-2-ylpiperidin-4-yl)pyrrole-2-carboxamide Openeye Name: 1-[2-[(5-chloro-2-pyridyl)amino]-2-oxo-ethyl]-N-(1-isopropyl-4-piperidyl)-4-nitro-pyrrole-2-carboxamide CAS Name: 1-[2-[(5-chloro-2-pyridinyl)amino]-2-oxoethyl]-4-nitro-N-(1-propan-2-yl-4-piperidinyl)-2-pyrrolecarboxamide IUPAC Name: 1-[2-[(5-chloropyridin-2-yl)amino]-2-oxoethyl]-4-nitro-N-(1-propan-2-ylpiperidin-4-yl)pyrrole-2-carboxamide Traditional Name: 1-[2-[(5-chloro-2-pyridyl)amino]-2-keto-ethyl]-N-(1-isopropyl-4-piperidyl)-4-nitro-pyrrole-2-carboxamide Formula: C20H25ClN6O4 MolecularWeight: 448.9033

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCC(CC1)NC(=O)C2=CC(=CN2CC(=O)NC3=NC=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)N1CCC(CC1)NC(=O)C2=CC(=CN2CC(=O)NC3=NC=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H25ClN6O4/c1-13(2)25-7-5-15(6-8-25)23-20(29)17-9-16(27(30)31)11-26(17)12-19(28)24-18-4-3-14(21)10-22-18/h3-4,9-11,13,15H,5-8,12H2,1-2H3,(H,23,29)(H,22,24,28)