1-[4-(aminomethyl)-3-chloranyl-phenyl]azepan-2-one

Systemtic Name: 1-[4-(aminomethyl)-3-chloranyl-phenyl]azepan-2-one Openeye Name: 1-[4-(aminomethyl)-3-chloro-phenyl]azepan-2-one CAS Name: 1-[4-(aminomethyl)-3-chlorophenyl]-2-azepanone IUPAC Name: 1-[4-(aminomethyl)-3-chlorophenyl]azepan-2-one Traditional Name: 1-[4-(aminomethyl)-3-chloro-phenyl]azepan-2-one Formula: C13H17ClN2O MolecularWeight: 252.73988

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)C2=CC(=C(C=C2)CN)Cl

Isomeric SMILES

C1CCC(=O)N(CC1)C2=CC(=C(C=C2)CN)Cl

InChI

InChI=1S/C13H17ClN2O/c14-12-8-11(6-5-10(12)9-15)16-7-3-1-2-4-13(16)17/h5-6,8H,1-4,7,9,15H2