4-azanyl-3-bromanyl-N-[1-[3-(4-fluoranylphenoxy)propyl]-4-methyl-piperidin-4-yl]-2-methoxy-benzamide

Systemtic Name: 4-azanyl-3-bromanyl-N-[1-[3-(4-fluoranylphenoxy)propyl]-4-methyl-piperidin-4-yl]-2-methoxy-benzamide Openeye Name: 4-amino-3-bromanyl-N-[1-[3-(4-fluorophenoxy)propyl]-4-methyl-4-piperidyl]-2-methoxy-benzamide CAS Name: 4-amino-3-bromanyl-N-[1-[3-(4-fluorophenoxy)propyl]-4-methyl-4-piperidinyl]-2-methoxybenzamide IUPAC Name: 4-amino-3-bromanyl-N-[1-[3-(4-fluorophenoxy)propyl]-4-methylpiperidin-4-yl]-2-methoxybenzamide Traditional Name: 4-amino-3-bromanyl-N-[1-[3-(4-fluorophenoxy)propyl]-4-methyl-4-piperidyl]-2-methoxy-benzamide Formula: C23H29BrFN3O3 MolecularWeight: 491.414443

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCN(CC1)CCCOC2=CC=C(C=C2)F)NC(=O)C3=C(C(=C(C=C3)N)Br)OC

Isomeric SMILES

CC1(CCN(CC1)CCCOC2=CC=C(C=C2)F)NC(=O)C3=C(C(=C(C=C3)N)[77Br])OC

InChI

InChI=1S/C23H29BrFN3O3/c1-23(27-22(29)18-8-9-19(26)20(24)21(18)30-2)10-13-28(14-11-23)12-3-15-31-17-6-4-16(25)5-7-17/h4-9H,3,10-15,26H2,1-2H3,(H,27,29)/i24-3