(2R,3S)-N-[3-(cyclopropylcarbamoyl)phenyl]-2,3-dimethyl-2,3-dihydro-1-benzofuran-7-carboxamide

Systemtic Name: (2R,3S)-N-[3-(cyclopropylcarbamoyl)phenyl]-2,3-dimethyl-2,3-dihydro-1-benzofuran-7-carboxamide Openeye Name: (2R,3S)-N-[3-(cyclopropylcarbamoyl)phenyl]-2,3-dimethyl-2,3-dihydrobenzofuran-7-carboxamide CAS Name: (2R,3S)-N-[3-[(cyclopropylamino)-oxomethyl]phenyl]-2,3-dimethyl-2,3-dihydrobenzofuran-7-carboxamide IUPAC Name: (2R,3S)-N-[3-(cyclopropylcarbamoyl)phenyl]-2,3-dimethyl-2,3-dihydro-1-benzofuran-7-carboxamide Traditional Name: (2R,3S)-N-[3-(cyclopropylcarbamoyl)phenyl]-2,3-dimethyl-coumaran-7-carboxamide Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(OC2=C(C=CC=C12)C(=O)NC3=CC=CC(=C3)C(=O)NC4CC4)C

Isomeric SMILES

C[C@@H]1[C@H](OC2=C(C=CC=C12)C(=O)NC3=CC=CC(=C3)C(=O)NC4CC4)C

InChI

InChI=1S/C21H22N2O3/c1-12-13(2)26-19-17(12)7-4-8-18(19)21(25)23-16-6-3-5-14(11-16)20(24)22-15-9-10-15/h3-8,11-13,15H,9-10H2,1-2H3,(H,22,24)(H,23,25)/t12-,13-/m1/s1