2-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-2-(5-methoxy-1H-indol-3-yl)ethanoic acid

Systemtic Name: 2-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-2-(5-methoxy-1H-indol-3-yl)ethanoic acid Openeye Name: 2-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-2-(5-methoxy-1H-indol-3-yl)acetic acid CAS Name: 2-[4-[(3-chlorophenyl)methyl]-1-piperazinyl]-2-(5-methoxy-1H-indol-3-yl)acetic acid IUPAC Name: 2-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-2-(5-methoxy-1H-indol-3-yl)acetic acid Traditional Name: 2-[4-(3-chlorobenzyl)piperazino]-2-(5-methoxy-1H-indol-3-yl)acetic acid Formula: C22H24ClN3O3 MolecularWeight: 413.89726

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC=C2C(C(=O)O)N3CCN(CC3)CC4=CC(=CC=C4)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)NC=C2C(C(=O)O)N3CCN(CC3)CC4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H24ClN3O3/c1-29-17-5-6-20-18(12-17)19(13-24-20)21(22(27)28)26-9-7-25(8-10-26)14-15-3-2-4-16(23)11-15/h2-6,11-13,21,24H,7-10,14H2,1H3,(H,27,28)