(2R)-2-(4-bromanylphenoxy)-N-[(Z)-(4-nitrothiophen-2-yl)methylideneamino]propanamide

Systemtic Name: (2R)-2-(4-bromanylphenoxy)-N-[(Z)-(4-nitrothiophen-2-yl)methylideneamino]propanamide Openeye Name: (2R)-2-(4-bromophenoxy)-N-[(Z)-(4-nitro-2-thienyl)methyleneamino]propanamide CAS Name: (2R)-2-(4-bromophenoxy)-N-[(Z)-(4-nitro-2-thiophenyl)methylideneamino]propanamide IUPAC Name: (2R)-2-(4-bromophenoxy)-N-[(Z)-(4-nitrothiophen-2-yl)methylideneamino]propanamide Traditional Name: (2R)-2-(4-bromophenoxy)-N-[(Z)-(4-nitro-2-thienyl)methyleneamino]propionamide Formula: C14H12BrN3O4S MolecularWeight: 398.23178

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NN=CC1=CC(=CS1)[N+](=O)[O-])OC2=CC=C(C=C2)Br

Isomeric SMILES

C[C@H](C(=O)N/N=C\C1=CC(=CS1)[N+](=O)[O-])OC2=CC=C(C=C2)Br

InChI

InChI=1S/C14H12BrN3O4S/c1-9(22-12-4-2-10(15)3-5-12)14(19)17-16-7-13-6-11(8-23-13)18(20)21/h2-9H,1H3,(H,17,19)/b16-7-/t9-/m1/s1