3-[3-(5-carbamimidoyl-1H-indol-2-yl)-5-(3-nitrophenyl)-4-oxidanyl-phenyl]propanoic acid

Systemtic Name: 3-[3-(5-carbamimidoyl-1H-indol-2-yl)-5-(3-nitrophenyl)-4-oxidanyl-phenyl]propanoic acid Openeye Name: 3-[3-(5-carbamimidoyl-1H-indol-2-yl)-4-hydroxy-5-(3-nitrophenyl)phenyl]propanoic acid CAS Name: 3-[3-(5-carbamimidoyl-1H-indol-2-yl)-4-hydroxy-5-(3-nitrophenyl)phenyl]propanoic acid IUPAC Name: 3-[3-(5-carbamimidoyl-1H-indol-2-yl)-4-hydroxy-5-(3-nitrophenyl)phenyl]propanoic acid Traditional Name: 3-[3-(5-amidino-1H-indol-2-yl)-4-hydroxy-5-(3-nitrophenyl)phenyl]propionic acid Formula: C24H20N4O5 MolecularWeight: 444.4394

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CC(=CC(=C2O)C3=CC4=C(N3)C=CC(=C4)C(=N)N)CCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CC(=CC(=C2O)C3=CC4=C(N3)C=CC(=C4)C(=N)N)CCC(=O)O

InChI

InChI=1S/C24H20N4O5/c25-24(26)15-5-6-20-16(10-15)12-21(27-20)19-9-13(4-7-22(29)30)8-18(23(19)31)14-2-1-3-17(11-14)28(32)33/h1-3,5-6,8-12,27,31H,4,7H2,(H3,25,26)(H,29,30)