N-[(2R)-2-(furan-2-yl)-2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-2-methyl-propanamide

Systemtic Name: N-[(2R)-2-(furan-2-yl)-2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-2-methyl-propanamide Openeye Name: N-[(2R)-2-(2-furyl)-2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-2-methyl-propanamide CAS Name: N-[(2R)-2-(2-furanyl)-2-(4-phenyl-1-piperazin-1-iumyl)ethyl]-2-methylpropanamide IUPAC Name: N-[(2R)-2-(furan-2-yl)-2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-2-methylpropanamide Traditional Name: N-[(2R)-2-(2-furyl)-2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-2-methyl-propionamide Formula: C20H28N3O2+ MolecularWeight: 342.45522

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NCC(C1=CC=CO1)[NH+]2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CC(C)C(=O)NC[C@H](C1=CC=CO1)[NH+]2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C20H27N3O2/c1-16(2)20(24)21-15-18(19-9-6-14-25-19)23-12-10-22(11-13-23)17-7-4-3-5-8-17/h3-9,14,16,18H,10-13,15H2,1-2H3,(H,21,24)/p+1/t18-/m1/s1