2-(azepan-1-yl)-4-bromanyl-benzaldehyde

Systemtic Name: 2-(azepan-1-yl)-4-bromanyl-benzaldehyde Openeye Name: 2-(azepan-1-yl)-4-bromo-benzaldehyde CAS Name: 2-(1-azepanyl)-4-bromobenzaldehyde IUPAC Name: 2-(azepan-1-yl)-4-bromobenzaldehyde Traditional Name: 2-(azepan-1-yl)-4-bromo-benzaldehyde Formula: C13H16BrNO MolecularWeight: 282.17624

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C=CC(=C2)Br)C=O

Isomeric SMILES

C1CCCN(CC1)C2=C(C=CC(=C2)Br)C=O

InChI

InChI=1S/C13H16BrNO/c14-12-6-5-11(10-16)13(9-12)15-7-3-1-2-4-8-15/h5-6,9-10H,1-4,7-8H2