2-[4-[(1R)-5-bromanyl-2,3-dihydro-1H-inden-1-yl]-2-methyl-piperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-[(1R)-5-bromanyl-2,3-dihydro-1H-inden-1-yl]-2-methyl-piperazin-1-yl]ethanoic acid Openeye Name: 2-[4-[(1R)-5-bromoindan-1-yl]-2-methyl-piperazin-1-yl]acetic acid CAS Name: 2-[4-[(1R)-5-bromo-2,3-dihydro-1H-inden-1-yl]-2-methyl-1-piperazinyl]acetic acid IUPAC Name: 2-[4-[(1R)-5-bromo-2,3-dihydro-1H-inden-1-yl]-2-methylpiperazin-1-yl]acetic acid Traditional Name: 2-[4-[(1R)-5-bromoindan-1-yl]-2-methyl-piperazino]acetic acid Formula: C16H21BrN2O2 MolecularWeight: 353.25414

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1CC(=O)O)C2CCC3=C2C=CC(=C3)Br

Isomeric SMILES

CC1CN(CCN1CC(=O)O)[C@@H]2CCC3=C2C=CC(=C3)Br

InChI

InChI=1S/C16H21BrN2O2/c1-11-9-19(7-6-18(11)10-16(20)21)15-5-2-12-8-13(17)3-4-14(12)15/h3-4,8,11,15H,2,5-7,9-10H2,1H3,(H,20,21)/t11?,15-/m1/s1