ethyl 2-[3-[4-(cyclohexylcarbamoylamino)phenyl]propanoylamino]-4,5-dimethoxy-benzoate

Systemtic Name: ethyl 2-[3-[4-(cyclohexylcarbamoylamino)phenyl]propanoylamino]-4,5-dimethoxy-benzoate Openeye Name: ethyl 2-[3-[4-(cyclohexylcarbamoylamino)phenyl]propanoylamino]-4,5-dimethoxy-benzoate CAS Name: 2-[[3-[4-[[(cyclohexylamino)-oxomethyl]amino]phenyl]-1-oxopropyl]amino]-4,5-dimethoxybenzoic acid ethyl ester IUPAC Name: ethyl 2-[3-[4-(cyclohexylcarbamoylamino)phenyl]propanoylamino]-4,5-dimethoxybenzoate Traditional Name: 2-[3-[4-(cyclohexylcarbamoylamino)phenyl]propanoylamino]-4,5-dimethoxy-benzoic acid ethyl ester Formula: C27H35N3O6 MolecularWeight: 497.5833

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1NC(=O)CCC2=CC=C(C=C2)NC(=O)NC3CCCCC3)OC)OC

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1NC(=O)CCC2=CC=C(C=C2)NC(=O)NC3CCCCC3)OC)OC

InChI

InChI=1S/C27H35N3O6/c1-4-36-26(32)21-16-23(34-2)24(35-3)17-22(21)30-25(31)15-12-18-10-13-20(14-11-18)29-27(33)28-19-8-6-5-7-9-19/h10-11,13-14,16-17,19H,4-9,12,15H2,1-3H3,(H,30,31)(H2,28,29,33)