prop-2-enyl 3-[[2-oxidanylidene-2-[[2-(2-propylpentanoyl)phenyl]amino]ethyl]carbamoylamino]benzoate

Systemtic Name: prop-2-enyl 3-[[2-oxidanylidene-2-[[2-(2-propylpentanoyl)phenyl]amino]ethyl]carbamoylamino]benzoate Openeye Name: allyl 3-[[2-oxo-2-[2-(2-propylpentanoyl)anilino]ethyl]carbamoylamino]benzoate CAS Name: 3-[[oxo-[[2-oxo-2-[2-(1-oxo-2-propylpentyl)anilino]ethyl]amino]methyl]amino]benzoic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 3-[[2-oxo-2-[2-(2-propylpentanoyl)anilino]ethyl]carbamoylamino]benzoate Traditional Name: 3-[[2-keto-2-[2-(2-propylpentanoyl)anilino]ethyl]carbamoylamino]benzoic acid allyl ester Formula: C27H33N3O5 MolecularWeight: 479.56802

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)C(=O)C1=CC=CC=C1NC(=O)CNC(=O)NC2=CC=CC(=C2)C(=O)OCC=C

Isomeric SMILES

CCCC(CCC)C(=O)C1=CC=CC=C1NC(=O)CNC(=O)NC2=CC=CC(=C2)C(=O)OCC=C

InChI

InChI=1S/C27H33N3O5/c1-4-10-19(11-5-2)25(32)22-14-7-8-15-23(22)30-24(31)18-28-27(34)29-21-13-9-12-20(17-21)26(33)35-16-6-3/h6-9,12-15,17,19H,3-5,10-11,16,18H2,1-2H3,(H,30,31)(H2,28,29,34)