cycloheptyl (E)-3-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)prop-2-enoate

Systemtic Name: cycloheptyl (E)-3-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)prop-2-enoate Openeye Name: cycloheptyl (E)-3-(4-methoxy-3-morpholinosulfonyl-phenyl)prop-2-enoate CAS Name: (E)-3-[4-methoxy-3-(4-morpholinylsulfonyl)phenyl]-2-propenoic acid cycloheptyl ester IUPAC Name: cycloheptyl (E)-3-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)prop-2-enoate Traditional Name: (E)-3-(4-methoxy-3-morpholinosulfonyl-phenyl)acrylic acid cycloheptyl ester Formula: C21H29NO6S MolecularWeight: 423.52306

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)OC2CCCCCC2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)OC2CCCCCC2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C21H29NO6S/c1-26-19-10-8-17(9-11-21(23)28-18-6-4-2-3-5-7-18)16-20(19)29(24,25)22-12-14-27-15-13-22/h8-11,16,18H,2-7,12-15H2,1H3/b11-9+