2-[[(E)-3-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)prop-2-enoyl]amino]benzamide

Systemtic Name: 2-[[(E)-3-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)prop-2-enoyl]amino]benzamide Openeye Name: 2-[[(E)-3-(4-methoxy-3-morpholinosulfonyl-phenyl)prop-2-enoyl]amino]benzamide CAS Name: 2-[[(E)-3-[4-methoxy-3-(4-morpholinylsulfonyl)phenyl]-1-oxoprop-2-enyl]amino]benzamide IUPAC Name: 2-[[(E)-3-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)prop-2-enoyl]amino]benzamide Traditional Name: 2-[[(E)-3-(4-methoxy-3-morpholinosulfonyl-phenyl)acryloyl]amino]benzamide Formula: C21H23N3O6S MolecularWeight: 445.48882

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)NC2=CC=CC=C2C(=O)N)S(=O)(=O)N3CCOCC3

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)NC2=CC=CC=C2C(=O)N)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C21H23N3O6S/c1-29-18-8-6-15(14-19(18)31(27,28)24-10-12-30-13-11-24)7-9-20(25)23-17-5-3-2-4-16(17)21(22)26/h2-9,14H,10-13H2,1H3,(H2,22,26)(H,23,25)/b9-7+