methyl 2-[4-(dimethylamino)-4-pyridin-2-yl-cyclohexyl]-3-(1H-indol-3-yl)propanoate

Systemtic Name: methyl 2-[4-(dimethylamino)-4-pyridin-2-yl-cyclohexyl]-3-(1H-indol-3-yl)propanoate Openeye Name: methyl 2-[4-(dimethylamino)-4-(2-pyridyl)cyclohexyl]-3-(1H-indol-3-yl)propanoate CAS Name: 2-[4-(dimethylamino)-4-(2-pyridinyl)cyclohexyl]-3-(1H-indol-3-yl)propanoic acid methyl ester IUPAC Name: methyl 2-[4-(dimethylamino)-4-pyridin-2-ylcyclohexyl]-3-(1H-indol-3-yl)propanoate Traditional Name: 2-[4-(dimethylamino)-4-(2-pyridyl)cyclohexyl]-3-(1H-indol-3-yl)propionic acid methyl ester Formula: C25H31N3O2 MolecularWeight: 405.53254

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1(CCC(CC1)C(CC2=CNC3=CC=CC=C32)C(=O)OC)C4=CC=CC=N4

Isomeric SMILES

CN(C)C1(CCC(CC1)C(CC2=CNC3=CC=CC=C32)C(=O)OC)C4=CC=CC=N4

InChI

InChI=1S/C25H31N3O2/c1-28(2)25(23-10-6-7-15-26-23)13-11-18(12-14-25)21(24(29)30-3)16-19-17-27-22-9-5-4-8-20(19)22/h4-10,15,17-18,21,27H,11-14,16H2,1-3H3