(6E)-4-bromanyl-6-[(piperidin-1-ylamino)methylidene]cyclohexa-2,4-dien-1-one; phosphoric acid

Systemtic Name: (6E)-4-bromanyl-6-[(piperidin-1-ylamino)methylidene]cyclohexa-2,4-dien-1-one; phosphoric acid Openeye Name: (6E)-4-bromo-6-[(1-piperidylamino)methylene]cyclohexa-2,4-dien-1-one; phosphoric acid CAS Name: (6E)-4-bromo-6-[(1-piperidinylamino)methylidene]-1-cyclohexa-2,4-dienone; phosphoric acid IUPAC Name: (6E)-4-bromo-6-[(piperidin-1-ylamino)methylidene]cyclohexa-2,4-dien-1-one; phosphoric acid Traditional Name: (6E)-4-bromo-6-[(piperidinoamino)methylene]cyclohexa-2,4-dien-1-one; phosphoric acid Formula: C12H18BrN2O5P MolecularWeight: 381.159481

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)NC=C2C=C(C=CC2=O)Br.OP(=O)(O)O

Isomeric SMILES

C1CCN(CC1)N/C=C/2\C=C(C=CC2=O)Br.OP(=O)(O)O

InChI

InChI=1S/C12H15BrN2O.H3O4P/c13-11-4-5-12(16)10(8-11)9-14-15-6-2-1-3-7-15;1-5(2,3)4/h4-5,8-9,14H,1-3,6-7H2;(H3,1,2,3,4)/b10-9+;