4-[(E)-3-(3-azanyl-4-fluoranyl-phenyl)prop-2-enoyl]piperazine-1-carbaldehyde

Systemtic Name: 4-[(E)-3-(3-azanyl-4-fluoranyl-phenyl)prop-2-enoyl]piperazine-1-carbaldehyde Openeye Name: 4-[(E)-3-(3-amino-4-fluoro-phenyl)prop-2-enoyl]piperazine-1-carbaldehyde CAS Name: 4-[(E)-3-(3-amino-4-fluorophenyl)-1-oxoprop-2-enyl]-1-piperazinecarboxaldehyde IUPAC Name: 4-[(E)-3-(3-amino-4-fluorophenyl)prop-2-enoyl]piperazine-1-carbaldehyde Traditional Name: 4-[(E)-3-(3-amino-4-fluoro-phenyl)acryloyl]piperazine-1-carbaldehyde Formula: C14H16FN3O2 MolecularWeight: 277.294143

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C=O)C(=O)C=CC2=CC(=C(C=C2)F)N

Isomeric SMILES

C1CN(CCN1C=O)C(=O)/C=C/C2=CC(=C(C=C2)F)N

InChI

InChI=1S/C14H16FN3O2/c15-12-3-1-11(9-13(12)16)2-4-14(20)18-7-5-17(10-19)6-8-18/h1-4,9-10H,5-8,16H2/b4-2+