N-[4-(diethylamino)butyl]-6-nitro-1,2-benzoxazole-3-carboxamide

Systemtic Name: N-[4-(diethylamino)butyl]-6-nitro-1,2-benzoxazole-3-carboxamide Openeye Name: N-[4-(diethylamino)butyl]-6-nitro-1,2-benzoxazole-3-carboxamide CAS Name: N-[4-(diethylamino)butyl]-6-nitro-1,2-benzoxazole-3-carboxamide IUPAC Name: N-[4-(diethylamino)butyl]-6-nitro-1,2-benzoxazole-3-carboxamide Traditional Name: N-[4-(diethylamino)butyl]-6-nitro-indoxazene-3-carboxamide Formula: C16H22N4O4 MolecularWeight: 334.37028

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCCNC(=O)C1=NOC2=C1C=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)CCCCNC(=O)C1=NOC2=C1C=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H22N4O4/c1-3-19(4-2)10-6-5-9-17-16(21)15-13-8-7-12(20(22)23)11-14(13)24-18-15/h7-8,11H,3-6,9-10H2,1-2H3,(H,17,21)