[2-[(4-morpholin-4-ylsulfonylphenyl)methylamino]-2-oxidanylidene-ethyl] (E)-3-quinolin-8-ylprop-2-enoate

Systemtic Name: [2-[(4-morpholin-4-ylsulfonylphenyl)methylamino]-2-oxidanylidene-ethyl] (E)-3-quinolin-8-ylprop-2-enoate Openeye Name: [2-[(4-morpholinosulfonylphenyl)methylamino]-2-oxo-ethyl] (E)-3-(8-quinolyl)prop-2-enoate CAS Name: (E)-3-(8-quinolinyl)-2-propenoic acid [2-[[4-(4-morpholinylsulfonyl)phenyl]methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(4-morpholin-4-ylsulfonylphenyl)methylamino]-2-oxoethyl] (E)-3-quinolin-8-ylprop-2-enoate Traditional Name: (E)-3-(8-quinolyl)acrylic acid [2-keto-2-[(4-morpholinosulfonylbenzyl)amino]ethyl] ester Formula: C25H25N3O6S MolecularWeight: 495.5475

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)CNC(=O)COC(=O)C=CC3=CC=CC4=C3N=CC=C4

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)CNC(=O)COC(=O)/C=C/C3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C25H25N3O6S/c29-23(18-34-24(30)11-8-21-4-1-3-20-5-2-12-26-25(20)21)27-17-19-6-9-22(10-7-19)35(31,32)28-13-15-33-16-14-28/h1-12H,13-18H2,(H,27,29)/b11-8+