N-[4-[(5-bromanyl-3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]propanamide

Systemtic Name: N-[4-[(5-bromanyl-3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]propanamide Openeye Name: N-[4-[(5-bromo-3-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]propanamide CAS Name: N-[4-[(5-bromo-3-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]phenyl]propanamide IUPAC Name: N-[4-[(5-bromo-3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]propanamide Traditional Name: N-[4-[(5-bromo-6-keto-3-nitro-cyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]propionamide Formula: C16H14BrN3O4 MolecularWeight: 392.20406

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)NC=C2C=C(C=C(C2=O)Br)[N+](=O)[O-]

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)NC=C2C=C(C=C(C2=O)Br)[N+](=O)[O-]

InChI

InChI=1S/C16H14BrN3O4/c1-2-15(21)19-12-5-3-11(4-6-12)18-9-10-7-13(20(23)24)8-14(17)16(10)22/h3-9,18H,2H2,1H3,(H,19,21)