4-imidazol-1-yl-3-nitro-N-(3-propan-2-yloxypropyl)benzamide

Systemtic Name: 4-imidazol-1-yl-3-nitro-N-(3-propan-2-yloxypropyl)benzamide Openeye Name: 4-imidazol-1-yl-N-(3-isopropoxypropyl)-3-nitro-benzamide CAS Name: 4-(1-imidazolyl)-3-nitro-N-(3-propan-2-yloxypropyl)benzamide IUPAC Name: 4-imidazol-1-yl-3-nitro-N-(3-propan-2-yloxypropyl)benzamide Traditional Name: 4-imidazol-1-yl-N-(3-isopropoxypropyl)-3-nitro-benzamide Formula: C16H20N4O4 MolecularWeight: 332.3544

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCNC(=O)C1=CC(=C(C=C1)N2C=CN=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)OCCCNC(=O)C1=CC(=C(C=C1)N2C=CN=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H20N4O4/c1-12(2)24-9-3-6-18-16(21)13-4-5-14(15(10-13)20(22)23)19-8-7-17-11-19/h4-5,7-8,10-12H,3,6,9H2,1-2H3,(H,18,21)