6-chloranyl-N-[(5-nitro-2-oxidanyl-phenyl)methyl]-3,4-dihydro-2H-chromene-3-carboxamide

Systemtic Name: 6-chloranyl-N-[(5-nitro-2-oxidanyl-phenyl)methyl]-3,4-dihydro-2H-chromene-3-carboxamide Openeye Name: 6-chloro-N-[(2-hydroxy-5-nitro-phenyl)methyl]chromane-3-carboxamide CAS Name: 6-chloro-N-[(2-hydroxy-5-nitrophenyl)methyl]-3,4-dihydro-2H-1-benzopyran-3-carboxamide IUPAC Name: 6-chloro-N-[(2-hydroxy-5-nitrophenyl)methyl]-3,4-dihydro-2H-chromene-3-carboxamide Traditional Name: 6-chloro-N-(2-hydroxy-5-nitro-benzyl)chroman-3-carboxamide Formula: C17H15ClN2O5 MolecularWeight: 362.7644

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Descriptors Computed from Structure

Canonical SMILES:

C1C(COC2=C1C=C(C=C2)Cl)C(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])O

Isomeric SMILES

C1C(COC2=C1C=C(C=C2)Cl)C(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])O

InChI

InChI=1S/C17H15ClN2O5/c18-13-1-4-16-10(6-13)5-12(9-25-16)17(22)19-8-11-7-14(20(23)24)2-3-15(11)21/h1-4,6-7,12,21H,5,8-9H2,(H,19,22)