(4S)-4-[(E)-4-(diphenylmethyl)oxy-2-nitro-but-1-enyl]-2,2-dimethyl-1,3-dioxolane

Systemtic Name: (4S)-4-[(E)-4-(diphenylmethyl)oxy-2-nitro-but-1-enyl]-2,2-dimethyl-1,3-dioxolane Openeye Name: (4S)-4-[(E)-4-benzhydryloxy-2-nitro-but-1-enyl]-2,2-dimethyl-1,3-dioxolane CAS Name: (4S)-4-[(E)-4-(diphenylmethyl)oxy-2-nitrobut-1-enyl]-2,2-dimethyl-1,3-dioxolane IUPAC Name: (4S)-4-[(E)-4-benzhydryloxy-2-nitrobut-1-enyl]-2,2-dimethyl-1,3-dioxolane Traditional Name: (4S)-4-[(E)-4-benzhydryloxy-2-nitro-but-1-enyl]-2,2-dimethyl-1,3-dioxolane Formula: C22H25NO5 MolecularWeight: 383.4376

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(O1)C=C(CCOC(C2=CC=CC=C2)C3=CC=CC=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1(OC[C@@H](O1)/C=C(\CCOC(C2=CC=CC=C2)C3=CC=CC=C3)/[N+](=O)[O-])C

InChI

InChI=1S/C22H25NO5/c1-22(2)27-16-20(28-22)15-19(23(24)25)13-14-26-21(17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-12,15,20-21H,13-14,16H2,1-2H3/b19-15+/t20-/m0/s1