4-[[(1E)-1-(6-aminocarbonyl-2-oxidanylidene-1H-indol-3-ylidene)butyl]amino]benzoic acid

Systemtic Name: 4-[[(1E)-1-(6-aminocarbonyl-2-oxidanylidene-1H-indol-3-ylidene)butyl]amino]benzoic acid Openeye Name: 4-[[(1E)-1-(6-carbamoyl-2-oxo-indolin-3-ylidene)butyl]amino]benzoic acid CAS Name: 4-[[(1E)-1-(6-carbamoyl-2-oxo-1H-indol-3-ylidene)butyl]amino]benzoic acid IUPAC Name: 4-[[(1E)-1-(6-carbamoyl-2-oxo-1H-indol-3-ylidene)butyl]amino]benzoic acid Traditional Name: 4-[[(1E)-1-(6-carbamoyl-2-keto-indolin-3-ylidene)butyl]amino]benzoic acid Formula: C20H19N3O4 MolecularWeight: 365.38256

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=C1C2=C(C=C(C=C2)C(=O)N)NC1=O)NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CCC/C(=C\1/C2=C(C=C(C=C2)C(=O)N)NC1=O)/NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C20H19N3O4/c1-2-3-15(22-13-7-4-11(5-8-13)20(26)27)17-14-9-6-12(18(21)24)10-16(14)23-19(17)25/h4-10,22H,2-3H2,1H3,(H2,21,24)(H,23,25)(H,26,27)/b17-15+