N-[(2R)-2-(4-tert-butylphenyl)-2-morpholin-4-yl-ethyl]-5-chloranyl-3,6-dimethyl-1-benzofuran-2-carboxamide

Systemtic Name: N-[(2R)-2-(4-tert-butylphenyl)-2-morpholin-4-yl-ethyl]-5-chloranyl-3,6-dimethyl-1-benzofuran-2-carboxamide Openeye Name: N-[(2R)-2-(4-tert-butylphenyl)-2-morpholino-ethyl]-5-chloro-3,6-dimethyl-benzofuran-2-carboxamide CAS Name: N-[(2R)-2-(4-tert-butylphenyl)-2-(4-morpholinyl)ethyl]-5-chloro-3,6-dimethyl-2-benzofurancarboxamide IUPAC Name: N-[(2R)-2-(4-tert-butylphenyl)-2-morpholin-4-ylethyl]-5-chloro-3,6-dimethyl-1-benzofuran-2-carboxamide Traditional Name: N-[(2R)-2-(4-tert-butylphenyl)-2-morpholino-ethyl]-5-chloro-3,6-dimethyl-coumarilamide Formula: C27H33ClN2O3 MolecularWeight: 469.01552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C(OC2=C1)C(=O)NCC(C3=CC=C(C=C3)C(C)(C)C)N4CCOCC4)C)Cl

Isomeric SMILES

CC1=C(C=C2C(=C(OC2=C1)C(=O)NC[C@@H](C3=CC=C(C=C3)C(C)(C)C)N4CCOCC4)C)Cl

InChI

InChI=1S/C27H33ClN2O3/c1-17-14-24-21(15-22(17)28)18(2)25(33-24)26(31)29-16-23(30-10-12-32-13-11-30)19-6-8-20(9-7-19)27(3,4)5/h6-9,14-15,23H,10-13,16H2,1-5H3,(H,29,31)/t23-/m0/s1