ethyl 6-bromanyl-2-[(4-ethoxycarbonyl-4-phenyl-piperidin-1-yl)methyl]-5-methoxy-1-phenyl-indole-3-carboxylate

Systemtic Name: ethyl 6-bromanyl-2-[(4-ethoxycarbonyl-4-phenyl-piperidin-1-yl)methyl]-5-methoxy-1-phenyl-indole-3-carboxylate Openeye Name: ethyl 6-bromo-2-[(4-ethoxycarbonyl-4-phenyl-1-piperidyl)methyl]-5-methoxy-1-phenyl-indole-3-carboxylate CAS Name: 6-bromo-2-[(4-ethoxycarbonyl-4-phenyl-1-piperidinyl)methyl]-5-methoxy-1-phenyl-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-2-[(4-ethoxycarbonyl-4-phenylpiperidin-1-yl)methyl]-5-methoxy-1-phenylindole-3-carboxylate Traditional Name: 6-bromo-2-[(4-carbethoxy-4-phenyl-piperidino)methyl]-5-methoxy-1-phenyl-indole-3-carboxylic acid ethyl ester Formula: C33H35BrN2O5 MolecularWeight: 619.5454

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OC)Br)C3=CC=CC=C3)CN4CCC(CC4)(C5=CC=CC=C5)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OC)Br)C3=CC=CC=C3)CN4CCC(CC4)(C5=CC=CC=C5)C(=O)OCC

InChI

InChI=1S/C33H35BrN2O5/c1-4-40-31(37)30-25-20-29(39-3)26(34)21-27(25)36(24-14-10-7-11-15-24)28(30)22-35-18-16-33(17-19-35,32(38)41-5-2)23-12-8-6-9-13-23/h6-15,20-21H,4-5,16-19,22H2,1-3H3