(3S)-1-[(6-nitro-3,4-dihydro-2H-1,4-benzoxazin-2-yl)methyl]pyrrolidin-3-ol

Systemtic Name: (3S)-1-[(6-nitro-3,4-dihydro-2H-1,4-benzoxazin-2-yl)methyl]pyrrolidin-3-ol Openeye Name: (3S)-1-[(6-nitro-3,4-dihydro-2H-1,4-benzoxazin-2-yl)methyl]pyrrolidin-3-ol CAS Name: (3S)-1-[(6-nitro-3,4-dihydro-2H-1,4-benzoxazin-2-yl)methyl]-3-pyrrolidinol IUPAC Name: (3S)-1-[(6-nitro-3,4-dihydro-2H-1,4-benzoxazin-2-yl)methyl]pyrrolidin-3-ol Traditional Name: (3S)-1-[(6-nitro-3,4-dihydro-2H-1,4-benzoxazin-2-yl)methyl]pyrrolidin-3-ol Formula: C13H17N3O4 MolecularWeight: 279.29178

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1O)CC2CNC3=C(O2)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(C[C@H]1O)CC2CNC3=C(O2)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C13H17N3O4/c17-10-3-4-15(7-10)8-11-6-14-12-5-9(16(18)19)1-2-13(12)20-11/h1-2,5,10-11,14,17H,3-4,6-8H2/t10-,11?/m0/s1