(E)-2-(2-chlorophenyl)-3-[2-nitro-5-(thiophen-3-ylmethoxy)phenyl]prop-2-en-1-ol

Systemtic Name: (E)-2-(2-chlorophenyl)-3-[2-nitro-5-(thiophen-3-ylmethoxy)phenyl]prop-2-en-1-ol Openeye Name: (E)-2-(2-chlorophenyl)-3-[2-nitro-5-(3-thienylmethoxy)phenyl]prop-2-en-1-ol CAS Name: (E)-2-(2-chlorophenyl)-3-[2-nitro-5-(3-thiophenylmethoxy)phenyl]-2-propen-1-ol IUPAC Name: (E)-2-(2-chlorophenyl)-3-[2-nitro-5-(thiophen-3-ylmethoxy)phenyl]prop-2-en-1-ol Traditional Name: (E)-2-(2-chlorophenyl)-3-[2-nitro-5-(3-thenyloxy)phenyl]prop-2-en-1-ol Formula: C20H16ClNO4S MolecularWeight: 401.86334

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=CC2=C(C=CC(=C2)OCC3=CSC=C3)[N+](=O)[O-])CO)Cl

Isomeric SMILES

C1=CC=C(C(=C1)/C(=C\C2=C(C=CC(=C2)OCC3=CSC=C3)[N+](=O)[O-])/CO)Cl

InChI

InChI=1S/C20H16ClNO4S/c21-19-4-2-1-3-18(19)16(11-23)9-15-10-17(5-6-20(15)22(24)25)26-12-14-7-8-27-13-14/h1-10,13,23H,11-12H2/b16-9-