sodium 2-[1-aminocarbonyl-5-(phenylmethyl)benzo[b]carbazol-11-yl]oxyethanoate

Systemtic Name: sodium 2-[1-aminocarbonyl-5-(phenylmethyl)benzo[b]carbazol-11-yl]oxyethanoate Openeye Name: sodium 2-(5-benzyl-1-carbamoyl-benzo[b]carbazol-11-yl)oxyacetate CAS Name: sodium 2-[[1-carbamoyl-5-(phenylmethyl)-11-benzo[b]carbazolyl]oxy]acetate IUPAC Name: sodium 2-(5-benzyl-1-carbamoylbenzo[b]carbazol-11-yl)oxyacetate Traditional Name: sodium 2-(5-benzyl-1-carbamoyl-benzo[b]carbazol-11-yl)oxyacetate Formula: C26H19N2NaO4 MolecularWeight: 446.42983

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=CC=CC(=C3C4=C(C5=CC=CC=C5C=C42)OCC(=O)[O-])C(=O)N.[Na+]

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=CC=CC(=C3C4=C(C5=CC=CC=C5C=C42)OCC(=O)[O-])C(=O)N.[Na+]

InChI

InChI=1S/C26H20N2O4.Na/c27-26(31)19-11-6-12-20-23(19)24-21(28(20)14-16-7-2-1-3-8-16)13-17-9-4-5-10-18(17)25(24)32-15-22(29)30;/h1-13H,14-15H2,(H2,27,31)(H,29,30);/q;+1/p-1