2-[[3-(1,2,3,4-tetrahydrocarbazol-9-yl)propanoylamino]carbamoyl]benzoic acid

Systemtic Name: 2-[[3-(1,2,3,4-tetrahydrocarbazol-9-yl)propanoylamino]carbamoyl]benzoic acid Openeye Name: 2-[[3-(1,2,3,4-tetrahydrocarbazol-9-yl)propanoylamino]carbamoyl]benzoic acid CAS Name: 2-[oxo-[[1-oxo-3-(1,2,3,4-tetrahydrocarbazol-9-yl)propyl]hydrazo]methyl]benzoic acid IUPAC Name: 2-[[3-(1,2,3,4-tetrahydrocarbazol-9-yl)propanoylamino]carbamoyl]benzoic acid Traditional Name: 2-[[3-(1,2,3,4-tetrahydrocarbazol-9-yl)propanoylamino]carbamoyl]benzoic acid Formula: C23H23N3O4 MolecularWeight: 405.44642

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C3=CC=CC=C3N2CCC(=O)NNC(=O)C4=CC=CC=C4C(=O)O

Isomeric SMILES

C1CCC2=C(C1)C3=CC=CC=C3N2CCC(=O)NNC(=O)C4=CC=CC=C4C(=O)O

InChI

InChI=1S/C23H23N3O4/c27-21(24-25-22(28)17-9-1-2-10-18(17)23(29)30)13-14-26-19-11-5-3-7-15(19)16-8-4-6-12-20(16)26/h1-3,5,7,9-11H,4,6,8,12-14H2,(H,24,27)(H,25,28)(H,29,30)