3-methoxy-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]-4-prop-2-enoxy-benzamide

Systemtic Name: 3-methoxy-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]-4-prop-2-enoxy-benzamide Openeye Name: 4-allyloxy-3-methoxy-N-[2-(4-methylsulfonyl-2-nitro-anilino)ethyl]benzamide CAS Name: 3-methoxy-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]-4-prop-2-enoxybenzamide IUPAC Name: 3-methoxy-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]-4-prop-2-enoxybenzamide Traditional Name: 4-allyloxy-N-[2-(4-mesyl-2-nitro-anilino)ethyl]-3-methoxy-benzamide Formula: C20H23N3O7S MolecularWeight: 449.47752

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)NCCNC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-])OCC=C

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)NCCNC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-])OCC=C

InChI

InChI=1S/C20H23N3O7S/c1-4-11-30-18-8-5-14(12-19(18)29-2)20(24)22-10-9-21-16-7-6-15(31(3,27)28)13-17(16)23(25)26/h4-8,12-13,21H,1,9-11H2,2-3H3,(H,22,24)