2-chloranyl-N-(3-methoxypropyl)-N-[(1-methylpyrrol-2-yl)methyl]-4-nitro-benzamide

Systemtic Name: 2-chloranyl-N-(3-methoxypropyl)-N-[(1-methylpyrrol-2-yl)methyl]-4-nitro-benzamide Openeye Name: 2-chloro-N-(3-methoxypropyl)-N-[(1-methylpyrrol-2-yl)methyl]-4-nitro-benzamide CAS Name: 2-chloro-N-(3-methoxypropyl)-N-[(1-methyl-2-pyrrolyl)methyl]-4-nitrobenzamide IUPAC Name: 2-chloro-N-(3-methoxypropyl)-N-[(1-methylpyrrol-2-yl)methyl]-4-nitrobenzamide Traditional Name: 2-chloro-N-(3-methoxypropyl)-N-[(1-methylpyrrol-2-yl)methyl]-4-nitro-benzamide Formula: C17H20ClN3O4 MolecularWeight: 365.8114

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1CN(CCCOC)C(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CN1C=CC=C1CN(CCCOC)C(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H20ClN3O4/c1-19-8-3-5-14(19)12-20(9-4-10-25-2)17(22)15-7-6-13(21(23)24)11-16(15)18/h3,5-8,11H,4,9-10,12H2,1-2H3