2-(4-chloranyl-1H-indol-3-yl)-2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]ethanoic acid

Systemtic Name: 2-(4-chloranyl-1H-indol-3-yl)-2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]ethanoic acid Openeye Name: 2-(4-chloro-1H-indol-3-yl)-2-[4-(1-naphthylmethyl)piperazin-1-yl]acetic acid CAS Name: 2-(4-chloro-1H-indol-3-yl)-2-[4-(1-naphthalenylmethyl)-1-piperazinyl]acetic acid IUPAC Name: 2-(4-chloro-1H-indol-3-yl)-2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]acetic acid Traditional Name: 2-(4-chloro-1H-indol-3-yl)-2-[4-(1-naphthylmethyl)piperazino]acetic acid Formula: C25H24ClN3O2 MolecularWeight: 433.92996

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC3=CC=CC=C32)C(C4=CNC5=C4C(=CC=C5)Cl)C(=O)O

Isomeric SMILES

C1CN(CCN1CC2=CC=CC3=CC=CC=C32)C(C4=CNC5=C4C(=CC=C5)Cl)C(=O)O

InChI

InChI=1S/C25H24ClN3O2/c26-21-9-4-10-22-23(21)20(15-27-22)24(25(30)31)29-13-11-28(12-14-29)16-18-7-3-6-17-5-1-2-8-19(17)18/h1-10,15,24,27H,11-14,16H2,(H,30,31)