(4-tert-butylphenyl)-(1-ethylpiperidin-4-yl)methanone; phenylmethanamine

Systemtic Name: (4-tert-butylphenyl)-(1-ethylpiperidin-4-yl)methanone; phenylmethanamine Openeye Name: (4-tert-butylphenyl)-(1-ethyl-4-piperidyl)methanone; phenylmethanamine CAS Name: (4-tert-butylphenyl)-(1-ethyl-4-piperidinyl)methanone; phenylmethanamine IUPAC Name: (4-tert-butylphenyl)-(1-ethylpiperidin-4-yl)methanone; phenylmethanamine Traditional Name: benzylamine; (4-tert-butylphenyl)-(1-ethyl-4-piperidyl)methanone Formula: C25H36N2O MolecularWeight: 380.56614

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27NO.C7H9N/c1-5-19-12-10-15(11-13-19)17(20)14-6-8-16(9-7-14)18(2,3)4;8-6-7-4-2-1-3-5-7/h6-9,15H,5,10-13H2,1-4H3;1-5H,6,8H2