N-[(3S)-2,2-dimethyl-7-nitro-3-oxidanyl-5-pyrrolidin-1-yl-3,4-dihydrochromen-6-yl]ethanamide

Systemtic Name: N-[(3S)-2,2-dimethyl-7-nitro-3-oxidanyl-5-pyrrolidin-1-yl-3,4-dihydrochromen-6-yl]ethanamide Openeye Name: N-[(3S)-3-hydroxy-2,2-dimethyl-7-nitro-5-pyrrolidin-1-yl-chroman-6-yl]acetamide CAS Name: N-[(3S)-3-hydroxy-2,2-dimethyl-7-nitro-5-(1-pyrrolidinyl)-3,4-dihydro-2H-1-benzopyran-6-yl]acetamide IUPAC Name: N-[(3S)-3-hydroxy-2,2-dimethyl-7-nitro-5-pyrrolidin-1-yl-3,4-dihydrochromen-6-yl]acetamide Traditional Name: N-[(3S)-3-hydroxy-2,2-dimethyl-7-nitro-5-pyrrolidino-chroman-6-yl]acetamide Formula: C17H23N3O5 MolecularWeight: 349.38162

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C2=C(C=C1[N+](=O)[O-])OC(C(C2)O)(C)C)N3CCCC3

Isomeric SMILES

CC(=O)NC1=C(C2=C(C=C1[N+](=O)[O-])OC([C@H](C2)O)(C)C)N3CCCC3

InChI

InChI=1S/C17H23N3O5/c1-10(21)18-15-12(20(23)24)9-13-11(8-14(22)17(2,3)25-13)16(15)19-6-4-5-7-19/h9,14,22H,4-8H2,1-3H3,(H,18,21)/t14-/m0/s1