diethyl 2-[2-[4-(3-thiophen-2-ylquinoxalin-2-yl)oxyphenyl]ethanoylamino]pentanedioate

Systemtic Name: diethyl 2-[2-[4-(3-thiophen-2-ylquinoxalin-2-yl)oxyphenyl]ethanoylamino]pentanedioate Openeye Name: diethyl 2-[[2-[4-[3-(2-thienyl)quinoxalin-2-yl]oxyphenyl]acetyl]amino]pentanedioate CAS Name: 2-[[1-oxo-2-[4-[(3-thiophen-2-yl-2-quinoxalinyl)oxy]phenyl]ethyl]amino]pentanedioic acid diethyl ester IUPAC Name: diethyl 2-[[2-[4-(3-thiophen-2-ylquinoxalin-2-yl)oxyphenyl]acetyl]amino]pentanedioate Traditional Name: 2-[[2-[4-[3-(2-thienyl)quinoxalin-2-yl]oxyphenyl]acetyl]amino]glutaric acid diethyl ester Formula: C29H29N3O6S MolecularWeight: 547.62206

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(C(=O)OCC)NC(=O)CC1=CC=C(C=C1)OC2=NC3=CC=CC=C3N=C2C4=CC=CS4

Isomeric SMILES

CCOC(=O)CCC(C(=O)OCC)NC(=O)CC1=CC=C(C=C1)OC2=NC3=CC=CC=C3N=C2C4=CC=CS4

InChI

InChI=1S/C29H29N3O6S/c1-3-36-26(34)16-15-23(29(35)37-4-2)30-25(33)18-19-11-13-20(14-12-19)38-28-27(24-10-7-17-39-24)31-21-8-5-6-9-22(21)32-28/h5-14,17,23H,3-4,15-16,18H2,1-2H3,(H,30,33)