N-tert-butyl-N-[4-(butylamino)-7-nitro-3-oxidanyl-2,2-di(propan-2-yl)-3,4-dihydrochromen-6-yl]ethanamide

Systemtic Name: N-tert-butyl-N-[4-(butylamino)-7-nitro-3-oxidanyl-2,2-di(propan-2-yl)-3,4-dihydrochromen-6-yl]ethanamide Openeye Name: N-tert-butyl-N-[4-(butylamino)-3-hydroxy-2,2-diisopropyl-7-nitro-chroman-6-yl]acetamide CAS Name: N-tert-butyl-N-[4-(butylamino)-3-hydroxy-7-nitro-2,2-di(propan-2-yl)-3,4-dihydro-2H-1-benzopyran-6-yl]acetamide IUPAC Name: N-tert-butyl-N-[4-(butylamino)-3-hydroxy-7-nitro-2,2-di(propan-2-yl)-3,4-dihydrochromen-6-yl]acetamide Traditional Name: N-tert-butyl-N-[4-(butylamino)-3-hydroxy-2,2-diisopropyl-7-nitro-chroman-6-yl]acetamide Formula: C25H41N3O5 MolecularWeight: 463.61014

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1C(C(OC2=CC(=C(C=C12)N(C(=O)C)C(C)(C)C)[N+](=O)[O-])(C(C)C)C(C)C)O

Isomeric SMILES

CCCCNC1C(C(OC2=CC(=C(C=C12)N(C(=O)C)C(C)(C)C)[N+](=O)[O-])(C(C)C)C(C)C)O

InChI

InChI=1S/C25H41N3O5/c1-10-11-12-26-22-18-13-19(27(17(6)29)24(7,8)9)20(28(31)32)14-21(18)33-25(15(2)3,16(4)5)23(22)30/h13-16,22-23,26,30H,10-12H2,1-9H3