(3S)-N-[3-(cyclopropylcarbamoyl)phenyl]-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: (3S)-N-[3-(cyclopropylcarbamoyl)phenyl]-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide Openeye Name: (3S)-N-[3-(cyclopropylcarbamoyl)phenyl]-1-oxo-isochromane-3-carboxamide CAS Name: (3S)-N-[3-[(cyclopropylamino)-oxomethyl]phenyl]-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: (3S)-N-[3-(cyclopropylcarbamoyl)phenyl]-1-oxo-3,4-dihydroisochromene-3-carboxamide Traditional Name: (3S)-N-[3-(cyclopropylcarbamoyl)phenyl]-1-keto-isochroman-3-carboxamide Formula: C20H18N2O4 MolecularWeight: 350.36792

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC(=CC=C2)NC(=O)C3CC4=CC=CC=C4C(=O)O3

Isomeric SMILES

C1CC1NC(=O)C2=CC(=CC=C2)NC(=O)[C@@H]3CC4=CC=CC=C4C(=O)O3

InChI

InChI=1S/C20H18N2O4/c23-18(21-14-8-9-14)13-5-3-6-15(10-13)22-19(24)17-11-12-4-1-2-7-16(12)20(25)26-17/h1-7,10,14,17H,8-9,11H2,(H,21,23)(H,22,24)/t17-/m0/s1