(2R)-2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]-N-(4-methoxy-2-nitro-phenyl)propanamide

Systemtic Name: (2R)-2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]-N-(4-methoxy-2-nitro-phenyl)propanamide Openeye Name: (2R)-2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]-N-(4-methoxy-2-nitro-phenyl)propanamide CAS Name: (2R)-2-[4-(1H-indol-3-yl)-1-piperidin-1-iumyl]-N-(4-methoxy-2-nitrophenyl)propanamide IUPAC Name: (2R)-2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]-N-(4-methoxy-2-nitrophenyl)propanamide Traditional Name: (2R)-2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]-N-(4-methoxy-2-nitro-phenyl)propionamide Formula: C23H27N4O4+ MolecularWeight: 423.48488

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)OC)[N+](=O)[O-])[NH+]2CCC(CC2)C3=CNC4=CC=CC=C43

Isomeric SMILES

C[C@H](C(=O)NC1=C(C=C(C=C1)OC)[N+](=O)[O-])[NH+]2CCC(CC2)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C23H26N4O4/c1-15(23(28)25-21-8-7-17(31-2)13-22(21)27(29)30)26-11-9-16(10-12-26)19-14-24-20-6-4-3-5-18(19)20/h3-8,13-16,24H,9-12H2,1-2H3,(H,25,28)/p+1/t15-/m1/s1