(4-chlorophenyl)-(1-ethylpiperidin-4-yl)methanone; phenylmethanamine

Systemtic Name: (4-chlorophenyl)-(1-ethylpiperidin-4-yl)methanone; phenylmethanamine Openeye Name: (4-chlorophenyl)-(1-ethyl-4-piperidyl)methanone; phenylmethanamine CAS Name: (4-chlorophenyl)-(1-ethyl-4-piperidinyl)methanone; phenylmethanamine IUPAC Name: (4-chlorophenyl)-(1-ethylpiperidin-4-yl)methanone; phenylmethanamine Traditional Name: benzylamine; (4-chlorophenyl)-(1-ethyl-4-piperidyl)methanone Formula: C21H27ClN2O MolecularWeight: 358.90488

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC(CC1)C(=O)C2=CC=C(C=C2)Cl.C1=CC=C(C=C1)CN

Isomeric SMILES

CCN1CCC(CC1)C(=O)C2=CC=C(C=C2)Cl.C1=CC=C(C=C1)CN

InChI

InChI=1S/C14H18ClNO.C7H9N/c1-2-16-9-7-12(8-10-16)14(17)11-3-5-13(15)6-4-11;8-6-7-4-2-1-3-5-7/h3-6,12H,2,7-10H2,1H3;1-5H,6,8H2