4-(4-chlorophenyl)sulfanyl-3-(1,3-dioxolan-2-yl)-6-nitro-1,2-benzoxazole

Systemtic Name: 4-(4-chlorophenyl)sulfanyl-3-(1,3-dioxolan-2-yl)-6-nitro-1,2-benzoxazole Openeye Name: 4-(4-chlorophenyl)sulfanyl-3-(1,3-dioxolan-2-yl)-6-nitro-1,2-benzoxazole CAS Name: 4-[(4-chlorophenyl)thio]-3-(1,3-dioxolan-2-yl)-6-nitro-1,2-benzoxazole IUPAC Name: 4-(4-chlorophenyl)sulfanyl-3-(1,3-dioxolan-2-yl)-6-nitro-1,2-benzoxazole Traditional Name: 4-[(4-chlorophenyl)thio]-3-(1,3-dioxolan-2-yl)-6-nitro-indoxazene Formula: C16H11ClN2O5S MolecularWeight: 378.78694

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(O1)C2=NOC3=C2C(=CC(=C3)[N+](=O)[O-])SC4=CC=C(C=C4)Cl

Isomeric SMILES

C1COC(O1)C2=NOC3=C2C(=CC(=C3)[N+](=O)[O-])SC4=CC=C(C=C4)Cl

InChI

InChI=1S/C16H11ClN2O5S/c17-9-1-3-11(4-2-9)25-13-8-10(19(20)21)7-12-14(13)15(18-24-12)16-22-5-6-23-16/h1-4,7-8,16H,5-6H2