2-azanyl-5-nitro-N-(4-pyridin-3-ylbutyl)benzamide dihydrochloride

Systemtic Name: 2-azanyl-5-nitro-N-(4-pyridin-3-ylbutyl)benzamide dihydrochloride Openeye Name: 2-amino-5-nitro-N-[4-(3-pyridyl)butyl]benzamide dihydrochloride CAS Name: 2-amino-5-nitro-N-[4-(3-pyridinyl)butyl]benzamide dihydrochloride IUPAC Name: 2-amino-5-nitro-N-(4-pyridin-3-ylbutyl)benzamide dihydrochloride Traditional Name: 2-amino-5-nitro-N-[4-(3-pyridyl)butyl]benzamide dihydrochloride Formula: C16H20Cl2N4O3 MolecularWeight: 387.261

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CCCCNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N.Cl.Cl

Isomeric SMILES

C1=CC(=CN=C1)CCCCNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N.Cl.Cl

InChI

InChI=1S/C16H18N4O3.2ClH/c17-15-7-6-13(20(22)23)10-14(15)16(21)19-9-2-1-4-12-5-3-8-18-11-12;;/h3,5-8,10-11H,1-2,4,9,17H2,(H,19,21);2*1H