1-chloranyl-3-methoxy-5-[(E)-2-(4-nitrophenyl)sulfonylethenyl]-2-prop-2-ynoxy-benzene

Systemtic Name: 1-chloranyl-3-methoxy-5-[(E)-2-(4-nitrophenyl)sulfonylethenyl]-2-prop-2-ynoxy-benzene Openeye Name: 1-chloro-3-methoxy-5-[(E)-2-(4-nitrophenyl)sulfonylvinyl]-2-prop-2-ynoxy-benzene CAS Name: 1-chloro-3-methoxy-5-[(E)-2-(4-nitrophenyl)sulfonylethenyl]-2-prop-2-ynoxybenzene IUPAC Name: 1-chloro-3-methoxy-5-[(E)-2-(4-nitrophenyl)sulfonylethenyl]-2-prop-2-ynoxybenzene Traditional Name: 1-chloro-3-methoxy-5-[(E)-2-nosylvinyl]-2-propargyloxy-benzene Formula: C18H14ClNO6S MolecularWeight: 407.82486

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=CS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])Cl)OCC#C

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C/S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])Cl)OCC#C

InChI

InChI=1S/C18H14ClNO6S/c1-3-9-26-18-16(19)11-13(12-17(18)25-2)8-10-27(23,24)15-6-4-14(5-7-15)20(21)22/h1,4-8,10-12H,9H2,2H3/b10-8+