N-[(2R)-2-(4-dimethylaminophenyl)-2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-4-propan-2-yloxy-benzamide

Systemtic Name: N-[(2R)-2-(4-dimethylaminophenyl)-2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-4-propan-2-yloxy-benzamide Openeye Name: N-[(2R)-2-(4-dimethylaminophenyl)-2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-4-isopropoxy-benzamide CAS Name: N-[(2R)-2-(4-dimethylaminophenyl)-2-(4-phenyl-1-piperazin-1-iumyl)ethyl]-4-propan-2-yloxybenzamide IUPAC Name: N-[(2R)-2-(4-dimethylaminophenyl)-2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-4-propan-2-yloxybenzamide Traditional Name: N-[(2R)-2-(4-dimethylaminophenyl)-2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-4-isopropoxy-benzamide Formula: C30H39N4O2+ MolecularWeight: 487.65626

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C(=O)NCC(C2=CC=C(C=C2)N(C)C)[NH+]3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)C(=O)NC[C@@H](C2=CC=C(C=C2)N(C)C)[NH+]3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C30H38N4O2/c1-23(2)36-28-16-12-25(13-17-28)30(35)31-22-29(24-10-14-26(15-11-24)32(3)4)34-20-18-33(19-21-34)27-8-6-5-7-9-27/h5-17,23,29H,18-22H2,1-4H3,(H,31,35)/p+1/t29-/m0/s1