sodium 2-[[7-aminocarbonyl-11-(phenylmethyl)-1,2,3,4-tetrahydrobenzo[a]carbazol-6-yl]oxy]ethanoate

Systemtic Name: sodium 2-[[7-aminocarbonyl-11-(phenylmethyl)-1,2,3,4-tetrahydrobenzo[a]carbazol-6-yl]oxy]ethanoate Openeye Name: sodium 2-[(11-benzyl-7-carbamoyl-1,2,3,4-tetrahydrobenzo[a]carbazol-6-yl)oxy]acetate CAS Name: sodium 2-[[7-carbamoyl-11-(phenylmethyl)-1,2,3,4-tetrahydrobenzo[a]carbazol-6-yl]oxy]acetate IUPAC Name: sodium 2-[(11-benzyl-7-carbamoyl-1,2,3,4-tetrahydrobenzo[a]carbazol-6-yl)oxy]acetate Traditional Name: sodium 2-[(11-benzyl-7-carbamoyl-1,2,3,4-tetrahydrobenzo[a]carbazol-6-yl)oxy]acetate Formula: C26H23N2NaO4 MolecularWeight: 450.46159

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C3C(=C(C=C2C1)OCC(=O)[O-])C4=C(C=CC=C4N3CC5=CC=CC=C5)C(=O)N.[Na+]

Isomeric SMILES

C1CCC2=C3C(=C(C=C2C1)OCC(=O)[O-])C4=C(C=CC=C4N3CC5=CC=CC=C5)C(=O)N.[Na+]

InChI

InChI=1S/C26H24N2O4.Na/c27-26(31)19-11-6-12-20-23(19)24-21(32-15-22(29)30)13-17-9-4-5-10-18(17)25(24)28(20)14-16-7-2-1-3-8-16;/h1-3,6-8,11-13H,4-5,9-10,14-15H2,(H2,27,31)(H,29,30);/q;+1/p-1