4-azanyl-5-chloranyl-N-[1-(1-ethyl-2,4,6-triphenyl-pyridin-1-ium-3-yl)-3-methoxy-piperidin-2-yl]-2-methoxy-benzamide

Systemtic Name: 4-azanyl-5-chloranyl-N-[1-(1-ethyl-2,4,6-triphenyl-pyridin-1-ium-3-yl)-3-methoxy-piperidin-2-yl]-2-methoxy-benzamide Openeye Name: 4-amino-5-chloro-N-[1-(1-ethyl-2,4,6-triphenyl-pyridin-1-ium-3-yl)-3-methoxy-2-piperidyl]-2-methoxy-benzamide CAS Name: 4-amino-5-chloro-N-[1-(1-ethyl-2,4,6-triphenyl-3-pyridin-1-iumyl)-3-methoxy-2-piperidinyl]-2-methoxybenzamide IUPAC Name: 4-amino-5-chloro-N-[1-(1-ethyl-2,4,6-triphenylpyridin-1-ium-3-yl)-3-methoxypiperidin-2-yl]-2-methoxybenzamide Traditional Name: 4-amino-5-chloro-N-[1-(1-ethyl-2,4,6-triphenyl-pyridin-1-ium-3-yl)-3-methoxy-2-piperidyl]-2-methoxy-benzamide Formula: C39H40ClN4O3+ MolecularWeight: 648.2129

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(C=C(C(=C1C2=CC=CC=C2)N3CCCC(C3NC(=O)C4=CC(=C(C=C4OC)N)Cl)OC)C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CC[N+]1=C(C=C(C(=C1C2=CC=CC=C2)N3CCCC(C3NC(=O)C4=CC(=C(C=C4OC)N)Cl)OC)C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C39H39ClN4O3/c1-4-43-33(27-17-10-6-11-18-27)24-29(26-15-8-5-9-16-26)37(36(43)28-19-12-7-13-20-28)44-22-14-21-34(46-2)38(44)42-39(45)30-23-31(40)32(41)25-35(30)47-3/h5-13,15-20,23-25,34,38H,4,14,21-22H2,1-3H3,(H2-,41,42,45)/p+1