2-[4-[(4-methoxy-3,5-dimethyl-pyridin-2-yl)methyl]piperazin-1-yl]-2-(2-phenyl-1H-indol-3-yl)ethanoic acid

Systemtic Name: 2-[4-[(4-methoxy-3,5-dimethyl-pyridin-2-yl)methyl]piperazin-1-yl]-2-(2-phenyl-1H-indol-3-yl)ethanoic acid Openeye Name: 2-[4-[(4-methoxy-3,5-dimethyl-2-pyridyl)methyl]piperazin-1-yl]-2-(2-phenyl-1H-indol-3-yl)acetic acid CAS Name: 2-[4-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-1-piperazinyl]-2-(2-phenyl-1H-indol-3-yl)acetic acid IUPAC Name: 2-[4-[(4-methoxy-3,5-dimethylpyridin-2-yl)methyl]piperazin-1-yl]-2-(2-phenyl-1H-indol-3-yl)acetic acid Traditional Name: 2-[4-[(4-methoxy-3,5-dimethyl-2-pyridyl)methyl]piperazino]-2-(2-phenyl-1H-indol-3-yl)acetic acid Formula: C29H32N4O3 MolecularWeight: 484.58938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C(=C1OC)C)CN2CCN(CC2)C(C3=C(NC4=CC=CC=C43)C5=CC=CC=C5)C(=O)O

Isomeric SMILES

CC1=CN=C(C(=C1OC)C)CN2CCN(CC2)C(C3=C(NC4=CC=CC=C43)C5=CC=CC=C5)C(=O)O

InChI

InChI=1S/C29H32N4O3/c1-19-17-30-24(20(2)28(19)36-3)18-32-13-15-33(16-14-32)27(29(34)35)25-22-11-7-8-12-23(22)31-26(25)21-9-5-4-6-10-21/h4-12,17,27,31H,13-16,18H2,1-3H3,(H,34,35)