2-[3-(5-carbamimidoyl-1H-indol-2-yl)-5-(3-nitrophenyl)-4-oxidanyl-phenyl]ethyl dihydrogen phosphate

Systemtic Name: 2-[3-(5-carbamimidoyl-1H-indol-2-yl)-5-(3-nitrophenyl)-4-oxidanyl-phenyl]ethyl dihydrogen phosphate Openeye Name: 2-[3-(5-carbamimidoyl-1H-indol-2-yl)-4-hydroxy-5-(3-nitrophenyl)phenyl]ethyl dihydrogen phosphate CAS Name: 2-[3-(5-carbamimidoyl-1H-indol-2-yl)-4-hydroxy-5-(3-nitrophenyl)phenyl]ethyl dihydrogen phosphate IUPAC Name: 2-[3-(5-carbamimidoyl-1H-indol-2-yl)-4-hydroxy-5-(3-nitrophenyl)phenyl]ethyl dihydrogen phosphate Traditional Name: 2-[3-(5-amidino-1H-indol-2-yl)-4-hydroxy-5-(3-nitrophenyl)phenyl]ethyl dihydrogen phosphate Formula: C23H21N4O7P MolecularWeight: 496.409201

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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)CCOP(=O)(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)CCOP(=O)(O)O

InChI

InChI=1S/C23H21N4O7P/c24-23(25)15-4-5-20-16(10-15)12-21(26-20)19-9-13(6-7-34-35(31,32)33)8-18(22(19)28)14-2-1-3-17(11-14)27(29)30/h1-5,8-12,26,28H,6-7H2,(H3,24,25)(H2,31,32,33)