(4-methoxycarbonyl-2-nitro-phenyl)sulfanyl-propan-2-ylidene-azanium

Systemtic Name: (4-methoxycarbonyl-2-nitro-phenyl)sulfanyl-propan-2-ylidene-azanium Openeye Name: isopropylidene-(4-methoxycarbonyl-2-nitro-phenyl)sulfanyl-ammonium CAS Name: [(4-methoxycarbonyl-2-nitrophenyl)thio]-propan-2-ylideneammonium IUPAC Name: (4-methoxycarbonyl-2-nitrophenyl)sulfanyl-propan-2-ylideneazanium Traditional Name: [(4-carbomethoxy-2-nitro-phenyl)thio]-isopropylidene-ammonium Formula: C11H13N2O4S+ MolecularWeight: 269.29692

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Descriptors Computed from Structure

Canonical SMILES:

CC(=[NH+]SC1=C(C=C(C=C1)C(=O)OC)[N+](=O)[O-])C

Isomeric SMILES

CC(=[NH+]SC1=C(C=C(C=C1)C(=O)OC)[N+](=O)[O-])C

InChI

InChI=1S/C11H12N2O4S/c1-7(2)12-18-10-5-4-8(11(14)17-3)6-9(10)13(15)16/h4-6H,1-3H3/p+1