(E)-1-(azocan-1-yl)-3-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(azocan-1-yl)-3-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)prop-2-en-1-one Openeye Name: (E)-1-(azocan-1-yl)-3-(4-methoxy-3-morpholinosulfonyl-phenyl)prop-2-en-1-one CAS Name: (E)-1-(1-azocanyl)-3-[4-methoxy-3-(4-morpholinylsulfonyl)phenyl]-2-propen-1-one IUPAC Name: (E)-1-(azocan-1-yl)-3-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)prop-2-en-1-one Traditional Name: (E)-1-(azocan-1-yl)-3-(4-methoxy-3-morpholinosulfonyl-phenyl)prop-2-en-1-one Formula: C21H30N2O5S MolecularWeight: 422.5383

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)N2CCCCCCC2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)N2CCCCCCC2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C21H30N2O5S/c1-27-19-9-7-18(8-10-21(24)22-11-5-3-2-4-6-12-22)17-20(19)29(25,26)23-13-15-28-16-14-23/h7-10,17H,2-6,11-16H2,1H3/b10-8+