prop-2-enyl 3-[[(2-cyclohexylcarbonylphenyl)carbonylamino]methylcarbamoylamino]benzoate

Systemtic Name: prop-2-enyl 3-[[(2-cyclohexylcarbonylphenyl)carbonylamino]methylcarbamoylamino]benzoate Openeye Name: allyl 3-[[[2-(cyclohexanecarbonyl)benzoyl]amino]methylcarbamoylamino]benzoate CAS Name: 3-[[[[[[2-[cyclohexyl(oxo)methyl]phenyl]-oxomethyl]amino]methylamino]-oxomethyl]amino]benzoic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 3-[[[2-(cyclohexanecarbonyl)benzoyl]amino]methylcarbamoylamino]benzoate Traditional Name: 3-[[[2-(cyclohexanecarbonyl)benzoyl]amino]methylcarbamoylamino]benzoic acid allyl ester Formula: C26H29N3O5 MolecularWeight: 465.518102

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)C1=CC(=CC=C1)NC(=O)NCNC(=O)C2=CC=CC=C2C(=O)C3CCCCC3

Isomeric SMILES

C=CCOC(=O)C1=CC(=CC=C1)NC(=O)NCNC(=O)C2=CC=CC=C2[14C](=O)C3CCCCC3

InChI

InChI=1S/C26H29N3O5/c1-2-15-34-25(32)19-11-8-12-20(16-19)29-26(33)28-17-27-24(31)22-14-7-6-13-21(22)23(30)18-9-4-3-5-10-18/h2,6-8,11-14,16,18H,1,3-5,9-10,15,17H2,(H,27,31)(H2,28,29,33)/i23+2