(3S)-N-[2-(cyclopentylcarbamoyl)phenyl]-1-oxidanylidene-3-phenyl-3,4-dihydroisochromene-6-carboxamide

Systemtic Name: (3S)-N-[2-(cyclopentylcarbamoyl)phenyl]-1-oxidanylidene-3-phenyl-3,4-dihydroisochromene-6-carboxamide Openeye Name: (3S)-N-[2-(cyclopentylcarbamoyl)phenyl]-1-oxo-3-phenyl-isochromane-6-carboxamide CAS Name: (3S)-N-[2-[(cyclopentylamino)-oxomethyl]phenyl]-1-oxo-3-phenyl-3,4-dihydro-1H-2-benzopyran-6-carboxamide IUPAC Name: (3S)-N-[2-(cyclopentylcarbamoyl)phenyl]-1-oxo-3-phenyl-3,4-dihydroisochromene-6-carboxamide Traditional Name: (3S)-N-[2-(cyclopentylcarbamoyl)phenyl]-1-keto-3-phenyl-isochroman-6-carboxamide Formula: C28H26N2O4 MolecularWeight: 454.51704

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)C2=CC=CC=C2NC(=O)C3=CC4=C(C=C3)C(=O)OC(C4)C5=CC=CC=C5

Isomeric SMILES

C1CCC(C1)NC(=O)C2=CC=CC=C2NC(=O)C3=CC4=C(C=C3)C(=O)O[C@@H](C4)C5=CC=CC=C5

InChI

InChI=1S/C28H26N2O4/c31-26(30-24-13-7-6-12-23(24)27(32)29-21-10-4-5-11-21)19-14-15-22-20(16-19)17-25(34-28(22)33)18-8-2-1-3-9-18/h1-3,6-9,12-16,21,25H,4-5,10-11,17H2,(H,29,32)(H,30,31)/t25-/m0/s1