(3R)-3-(4-chlorophenyl)-N-(3-nitrophenyl)-1-oxidanylidene-3,4-dihydroisochromene-6-carboxamide

Systemtic Name: (3R)-3-(4-chlorophenyl)-N-(3-nitrophenyl)-1-oxidanylidene-3,4-dihydroisochromene-6-carboxamide Openeye Name: (3R)-3-(4-chlorophenyl)-N-(3-nitrophenyl)-1-oxo-isochromane-6-carboxamide CAS Name: (3R)-3-(4-chlorophenyl)-N-(3-nitrophenyl)-1-oxo-3,4-dihydro-1H-2-benzopyran-6-carboxamide IUPAC Name: (3R)-3-(4-chlorophenyl)-N-(3-nitrophenyl)-1-oxo-3,4-dihydroisochromene-6-carboxamide Traditional Name: (3R)-3-(4-chlorophenyl)-1-keto-N-(3-nitrophenyl)isochroman-6-carboxamide Formula: C22H15ClN2O5 MolecularWeight: 422.8179

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(=O)C2=C1C=C(C=C2)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-])C4=CC=C(C=C4)Cl

Isomeric SMILES

C1[C@@H](OC(=O)C2=C1C=C(C=C2)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-])C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H15ClN2O5/c23-16-7-4-13(5-8-16)20-11-15-10-14(6-9-19(15)22(27)30-20)21(26)24-17-2-1-3-18(12-17)25(28)29/h1-10,12,20H,11H2,(H,24,26)/t20-/m1/s1