[2-(cyclopentylcarbamoylamino)-2-oxidanylidene-ethyl] 3-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)prop-2-enoate

Systemtic Name: [2-(cyclopentylcarbamoylamino)-2-oxidanylidene-ethyl] 3-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)prop-2-enoate Openeye Name: [2-(cyclopentylcarbamoylamino)-2-oxo-ethyl] 3-(4-methoxy-3-morpholinosulfonyl-phenyl)prop-2-enoate CAS Name: 3-[4-methoxy-3-(4-morpholinylsulfonyl)phenyl]-2-propenoic acid [2-[[(cyclopentylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(cyclopentylcarbamoylamino)-2-oxoethyl] 3-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)prop-2-enoate Traditional Name: 3-(4-methoxy-3-morpholinosulfonyl-phenyl)acrylic acid [2-(cyclopentylcarbamoylamino)-2-keto-ethyl] ester Formula: C22H29N3O8S MolecularWeight: 495.54596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)OCC(=O)NC(=O)NC2CCCC2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

COC1=C(C=C(C=C1)C=CC(=O)OCC(=O)NC(=O)NC2CCCC2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C22H29N3O8S/c1-31-18-8-6-16(14-19(18)34(29,30)25-10-12-32-13-11-25)7-9-21(27)33-15-20(26)24-22(28)23-17-4-2-3-5-17/h6-9,14,17H,2-5,10-13,15H2,1H3,(H2,23,24,26,28)