azepan-1-yl-[4-(hexadecylamino)phenyl]methanone

Systemtic Name: azepan-1-yl-[4-(hexadecylamino)phenyl]methanone Openeye Name: azepan-1-yl-[4-(hexadecylamino)phenyl]methanone CAS Name: 1-azepanyl-[4-(hexadecylamino)phenyl]methanone IUPAC Name: azepan-1-yl-[4-(hexadecylamino)phenyl]methanone Traditional Name: azepan-1-yl-[4-(cetylamino)phenyl]methanone Formula: C29H50N2O MolecularWeight: 442.7201

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC1=CC=C(C=C1)C(=O)N2CCCCCC2

Isomeric SMILES

CCCCCCCCCCCCCCCCNC1=CC=C(C=C1)C(=O)N2CCCCCC2

InChI

InChI=1S/C29H50N2O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-24-30-28-22-20-27(21-23-28)29(32)31-25-18-15-16-19-26-31/h20-23,30H,2-19,24-26H2,1H3