[2-pentyl-3-[(1-phenethylpiperidin-4-yl)carbamoyl]-1-(phenylmethyl)indol-5-yl] ethanoate

Systemtic Name: [2-pentyl-3-[(1-phenethylpiperidin-4-yl)carbamoyl]-1-(phenylmethyl)indol-5-yl] ethanoate Openeye Name: [1-benzyl-2-pentyl-3-[(1-phenethyl-4-piperidyl)carbamoyl]indol-5-yl] acetate CAS Name: acetic acid [3-[oxo-[(1-phenethyl-4-piperidinyl)amino]methyl]-2-pentyl-1-(phenylmethyl)-5-indolyl] ester IUPAC Name: [1-benzyl-2-pentyl-3-[(1-phenethylpiperidin-4-yl)carbamoyl]indol-5-yl] acetate Traditional Name: acetic acid [2-amyl-1-benzyl-3-[(1-phenethyl-4-piperidyl)carbamoyl]indol-5-yl] ester Formula: C36H43N3O3 MolecularWeight: 565.74492

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C2=C(N1CC3=CC=CC=C3)C=CC(=C2)OC(=O)C)C(=O)NC4CCN(CC4)CCC5=CC=CC=C5

Isomeric SMILES

CCCCCC1=C(C2=C(N1CC3=CC=CC=C3)C=CC(=C2)OC(=O)C)C(=O)NC4CCN(CC4)CCC5=CC=CC=C5

InChI

InChI=1S/C36H43N3O3/c1-3-4-7-16-34-35(36(41)37-30-20-23-38(24-21-30)22-19-28-12-8-5-9-13-28)32-25-31(42-27(2)40)17-18-33(32)39(34)26-29-14-10-6-11-15-29/h5-6,8-15,17-18,25,30H,3-4,7,16,19-24,26H2,1-2H3,(H,37,41)