2-[2-methyl-4-[(R)-phenyl-(3-thiophen-2-ylphenyl)methyl]piperazin-1-yl]ethanoic acid

Systemtic Name: 2-[2-methyl-4-[(R)-phenyl-(3-thiophen-2-ylphenyl)methyl]piperazin-1-yl]ethanoic acid Openeye Name: 2-[2-methyl-4-[(R)-phenyl-[3-(2-thienyl)phenyl]methyl]piperazin-1-yl]acetic acid CAS Name: 2-[2-methyl-4-[(R)-phenyl-(3-thiophen-2-ylphenyl)methyl]-1-piperazinyl]acetic acid IUPAC Name: 2-[2-methyl-4-[(R)-phenyl-(3-thiophen-2-ylphenyl)methyl]piperazin-1-yl]acetic acid Traditional Name: 2-[2-methyl-4-[(R)-phenyl-[3-(2-thienyl)phenyl]methyl]piperazino]acetic acid Formula: C24H26N2O2S MolecularWeight: 406.54044

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1CC(=O)O)C(C2=CC=CC=C2)C3=CC=CC(=C3)C4=CC=CS4

Isomeric SMILES

CC1CN(CCN1CC(=O)O)[C@H](C2=CC=CC=C2)C3=CC=CC(=C3)C4=CC=CS4

InChI

InChI=1S/C24H26N2O2S/c1-18-16-26(13-12-25(18)17-23(27)28)24(19-7-3-2-4-8-19)21-10-5-9-20(15-21)22-11-6-14-29-22/h2-11,14-15,18,24H,12-13,16-17H2,1H3,(H,27,28)/t18?,24-/m1/s1