2-(2H-chromen-3-yl)-3-(4-phenylpiperazin-1-yl)propanoic acid

Systemtic Name: 2-(2H-chromen-3-yl)-3-(4-phenylpiperazin-1-yl)propanoic acid Openeye Name: 2-(2H-chromen-3-yl)-3-(4-phenylpiperazin-1-yl)propanoic acid CAS Name: 2-(2H-1-benzopyran-3-yl)-3-(4-phenyl-1-piperazinyl)propanoic acid IUPAC Name: 2-(2H-chromen-3-yl)-3-(4-phenylpiperazin-1-yl)propanoic acid Traditional Name: 2-(2H-chromen-3-yl)-3-(4-phenylpiperazino)propionic acid Formula: C22H24N2O3 MolecularWeight: 364.43756

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(C2=CC3=CC=CC=C3OC2)C(=O)O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC(C2=CC3=CC=CC=C3OC2)C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C22H24N2O3/c25-22(26)20(18-14-17-6-4-5-9-21(17)27-16-18)15-23-10-12-24(13-11-23)19-7-2-1-3-8-19/h1-9,14,20H,10-13,15-16H2,(H,25,26)