(2R)-N-(4-methoxy-2-nitro-phenyl)-2-(4-phenylpiperazin-1-ium-1-yl)propanamide

Systemtic Name: (2R)-N-(4-methoxy-2-nitro-phenyl)-2-(4-phenylpiperazin-1-ium-1-yl)propanamide Openeye Name: (2R)-N-(4-methoxy-2-nitro-phenyl)-2-(4-phenylpiperazin-1-ium-1-yl)propanamide CAS Name: (2R)-N-(4-methoxy-2-nitrophenyl)-2-(4-phenyl-1-piperazin-1-iumyl)propanamide IUPAC Name: (2R)-N-(4-methoxy-2-nitrophenyl)-2-(4-phenylpiperazin-1-ium-1-yl)propanamide Traditional Name: (2R)-N-(4-methoxy-2-nitro-phenyl)-2-(4-phenylpiperazin-1-ium-1-yl)propionamide Formula: C20H25N4O4+ MolecularWeight: 385.4369

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)OC)[N+](=O)[O-])[NH+]2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

C[C@H](C(=O)NC1=C(C=C(C=C1)OC)[N+](=O)[O-])[NH+]2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C20H24N4O4/c1-15(22-10-12-23(13-11-22)16-6-4-3-5-7-16)20(25)21-18-9-8-17(28-2)14-19(18)24(26)27/h3-9,14-15H,10-13H2,1-2H3,(H,21,25)/p+1/t15-/m1/s1