4-(3,4-dihydro-2H-thiochromen-4-ylamino)-3-nitro-phenol

Systemtic Name: 4-(3,4-dihydro-2H-thiochromen-4-ylamino)-3-nitro-phenol Openeye Name: 3-nitro-4-(thiochroman-4-ylamino)phenol CAS Name: 4-(3,4-dihydro-2H-1-benzothiopyran-4-ylamino)-3-nitrophenol IUPAC Name: 4-(3,4-dihydro-2H-thiochromen-4-ylamino)-3-nitrophenol Traditional Name: 3-nitro-4-(thiochroman-4-ylamino)phenol Formula: C15H14N2O3S MolecularWeight: 302.34826

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=CC=CC=C2C1NC3=C(C=C(C=C3)O)[N+](=O)[O-]

Isomeric SMILES

C1CSC2=CC=CC=C2C1NC3=C(C=C(C=C3)O)[N+](=O)[O-]

InChI

InChI=1S/C15H14N2O3S/c18-10-5-6-13(14(9-10)17(19)20)16-12-7-8-21-15-4-2-1-3-11(12)15/h1-6,9,12,16,18H,7-8H2