2-(4,5,6,7-tetrahydro-1H-1,3-diazepin-2-yl)benzaldehyde

Systemtic Name: 2-(4,5,6,7-tetrahydro-1H-1,3-diazepin-2-yl)benzaldehyde Openeye Name: 2-(4,5,6,7-tetrahydro-1H-1,3-diazepin-2-yl)benzaldehyde CAS Name: 2-(4,5,6,7-tetrahydro-1H-1,3-diazepin-2-yl)benzaldehyde IUPAC Name: 2-(4,5,6,7-tetrahydro-1H-1,3-diazepin-2-yl)benzaldehyde Traditional Name: 2-(4,5,6,7-tetrahydro-1H-1,3-diazepin-2-yl)benzaldehyde Formula: C12H14N2O MolecularWeight: 202.25236

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN=C(NC1)C2=CC=CC=C2C=O

Isomeric SMILES

C1CCN=C(NC1)C2=CC=CC=C2C=O

InChI

InChI=1S/C12H14N2O/c15-9-10-5-1-2-6-11(10)12-13-7-3-4-8-14-12/h1-2,5-6,9H,3-4,7-8H2,(H,13,14)