(2S)-2-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-ium-1-yl]-N-[(2-methoxyphenyl)methyl]propanamide

Systemtic Name: (2S)-2-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-ium-1-yl]-N-[(2-methoxyphenyl)methyl]propanamide Openeye Name: (2S)-2-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-ium-1-yl]-N-[(2-methoxyphenyl)methyl]propanamide CAS Name: (2S)-2-[4-(4-methoxy-3-nitrophenyl)sulfonyl-1-piperazin-1-iumyl]-N-[(2-methoxyphenyl)methyl]propanamide IUPAC Name: (2S)-2-[4-(4-methoxy-3-nitrophenyl)sulfonylpiperazin-1-ium-1-yl]-N-[(2-methoxyphenyl)methyl]propanamide Traditional Name: (2S)-2-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-ium-1-yl]-N-o-anisyl-propionamide Formula: C22H29N4O7S+ MolecularWeight: 493.55326

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1OC)[NH+]2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

C[C@@H](C(=O)NCC1=CC=CC=C1OC)[NH+]2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C22H28N4O7S/c1-16(22(27)23-15-17-6-4-5-7-20(17)32-2)24-10-12-25(13-11-24)34(30,31)18-8-9-21(33-3)19(14-18)26(28)29/h4-9,14,16H,10-13,15H2,1-3H3,(H,23,27)/p+1/t16-/m0/s1