5-chloranyl-1-(phenylmethyl)-2,3,6,7-tetrahydroazepine-4-carbaldehyde

Systemtic Name: 5-chloranyl-1-(phenylmethyl)-2,3,6,7-tetrahydroazepine-4-carbaldehyde Openeye Name: 1-benzyl-5-chloro-2,3,6,7-tetrahydroazepine-4-carbaldehyde CAS Name: 5-chloro-1-(phenylmethyl)-2,3,6,7-tetrahydroazepine-4-carboxaldehyde IUPAC Name: 1-benzyl-5-chloro-2,3,6,7-tetrahydroazepine-4-carbaldehyde Traditional Name: 1-benzyl-5-chloro-2,3,6,7-tetrahydroazepine-4-carbaldehyde Formula: C14H16ClNO MolecularWeight: 249.73594

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC(=C1C=O)Cl)CC2=CC=CC=C2

Isomeric SMILES

C1CN(CCC(=C1C=O)Cl)CC2=CC=CC=C2

InChI

InChI=1S/C14H16ClNO/c15-14-7-9-16(8-6-13(14)11-17)10-12-4-2-1-3-5-12/h1-5,11H,6-10H2