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

Systemtic Name: 4-[[(1E)-1-(6-methoxycarbonyl-2-oxidanylidene-1H-indol-3-ylidene)propyl]amino]benzoic acid Openeye Name: 4-[[(1E)-1-(6-methoxycarbonyl-2-oxo-indolin-3-ylidene)propyl]amino]benzoic acid CAS Name: 4-[[(1E)-1-(6-methoxycarbonyl-2-oxo-1H-indol-3-ylidene)propyl]amino]benzoic acid IUPAC Name: 4-[[(1E)-1-(6-methoxycarbonyl-2-oxo-1H-indol-3-ylidene)propyl]amino]benzoic acid Traditional Name: 4-[[(1E)-1-(6-carbomethoxy-2-keto-indolin-3-ylidene)propyl]amino]benzoic acid Formula: C20H18N2O5 MolecularWeight: 366.36732

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C1C2=C(C=C(C=C2)C(=O)OC)NC1=O)NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C20H18N2O5/c1-3-15(21-13-7-4-11(5-8-13)19(24)25)17-14-9-6-12(20(26)27-2)10-16(14)22-18(17)23/h4-10,21H,3H2,1-2H3,(H,22,23)(H,24,25)/b17-15+