1-nitro-3-[(1S,6S)-6-(phenylmethoxymethyl)cyclohex-2-en-1-yl]propan-2-ol

Systemtic Name: 1-nitro-3-[(1S,6S)-6-(phenylmethoxymethyl)cyclohex-2-en-1-yl]propan-2-ol Openeye Name: 1-[(1S,6S)-6-(benzyloxymethyl)cyclohex-2-en-1-yl]-3-nitro-propan-2-ol CAS Name: 1-nitro-3-[(1S,6S)-6-(phenylmethoxymethyl)-1-cyclohex-2-enyl]-2-propanol IUPAC Name: 1-nitro-3-[(1S,6S)-6-(phenylmethoxymethyl)cyclohex-2-en-1-yl]propan-2-ol Traditional Name: 1-[(1S,6S)-6-(benzoxymethyl)cyclohex-2-en-1-yl]-3-nitro-propan-2-ol Formula: C17H23NO4 MolecularWeight: 305.36882

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(C=C1)CC(C[N+](=O)[O-])O)COCC2=CC=CC=C2

Isomeric SMILES

C1C[C@@H]([C@H](C=C1)CC(C[N+](=O)[O-])O)COCC2=CC=CC=C2

InChI

InChI=1S/C17H23NO4/c19-17(11-18(20)21)10-15-8-4-5-9-16(15)13-22-12-14-6-2-1-3-7-14/h1-4,6-8,15-17,19H,5,9-13H2/t15-,16-,17?/m1/s1