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

Systemtic Name: methyl 4-[[(1E)-1-(6-aminocarbonyl-2-oxidanylidene-1H-indol-3-ylidene)butyl]amino]benzoate Openeye Name: methyl 4-[[(1E)-1-(6-carbamoyl-2-oxo-indolin-3-ylidene)butyl]amino]benzoate CAS Name: 4-[[(1E)-1-(6-carbamoyl-2-oxo-1H-indol-3-ylidene)butyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[(1E)-1-(6-carbamoyl-2-oxo-1H-indol-3-ylidene)butyl]amino]benzoate Traditional Name: 4-[[(1E)-1-(6-carbamoyl-2-keto-indolin-3-ylidene)butyl]amino]benzoic acid methyl ester Formula: C21H21N3O4 MolecularWeight: 379.40914

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C21H21N3O4/c1-3-4-16(23-14-8-5-12(6-9-14)21(27)28-2)18-15-10-7-13(19(22)25)11-17(15)24-20(18)26/h5-11,23H,3-4H2,1-2H3,(H2,22,25)(H,24,26)/b18-16+