3-bromanyl-4-butoxy-N-hexadecyl-benzamide

Systemtic Name: 3-bromanyl-4-butoxy-N-hexadecyl-benzamide Openeye Name: 3-bromo-4-butoxy-N-hexadecyl-benzamide CAS Name: 3-bromo-4-butoxy-N-hexadecylbenzamide IUPAC Name: 3-bromo-4-butoxy-N-hexadecylbenzamide Traditional Name: 3-bromo-4-butoxy-N-cetyl-benzamide Formula: C27H46BrNO2 MolecularWeight: 496.56364

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC(=O)C1=CC(=C(C=C1)OCCCC)Br

Isomeric SMILES

CCCCCCCCCCCCCCCCNC(=O)C1=CC(=C(C=C1)OCCCC)Br

InChI

InChI=1S/C27H46BrNO2/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-21-29-27(30)24-19-20-26(25(28)23-24)31-22-6-4-2/h19-20,23H,3-18,21-22H2,1-2H3,(H,29,30)