4,4-dimethyl-6-(3-nitrophenyl)-1H-3,1-benzoxazine-2-thione

Systemtic Name: 4,4-dimethyl-6-(3-nitrophenyl)-1H-3,1-benzoxazine-2-thione Openeye Name: 4,4-dimethyl-6-(3-nitrophenyl)-1H-3,1-benzoxazine-2-thione CAS Name: 4,4-dimethyl-6-(3-nitrophenyl)-1H-3,1-benzoxazine-2-thione IUPAC Name: 4,4-dimethyl-6-(3-nitrophenyl)-1H-3,1-benzoxazine-2-thione Traditional Name: 4,4-dimethyl-6-(3-nitrophenyl)-1H-3,1-benzoxazine-2-thione Formula: C16H14N2O3S MolecularWeight: 314.35896

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C=CC(=C2)C3=CC(=CC=C3)[N+](=O)[O-])NC(=S)O1)C

Isomeric SMILES

CC1(C2=C(C=CC(=C2)C3=CC(=CC=C3)[N+](=O)[O-])NC(=S)O1)C

InChI

InChI=1S/C16H14N2O3S/c1-16(2)13-9-11(6-7-14(13)17-15(22)21-16)10-4-3-5-12(8-10)18(19)20/h3-9H,1-2H3,(H,17,22)