3-(cyclohexylcarbamoylamino)-N-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]propanamide

Systemtic Name: 3-(cyclohexylcarbamoylamino)-N-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]propanamide Openeye Name: N-[(4-benzyloxy-3-methoxy-phenyl)methyl]-3-(cyclohexylcarbamoylamino)propanamide CAS Name: 3-[[(cyclohexylamino)-oxomethyl]amino]-N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]propanamide IUPAC Name: 3-(cyclohexylcarbamoylamino)-N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]propanamide Traditional Name: N-(4-benzoxy-3-methoxy-benzyl)-3-(cyclohexylcarbamoylamino)propionamide Formula: C25H33N3O4 MolecularWeight: 439.54722

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNC(=O)CCNC(=O)NC2CCCCC2)OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)CNC(=O)CCNC(=O)NC2CCCCC2)OCC3=CC=CC=C3

InChI

InChI=1S/C25H33N3O4/c1-31-23-16-20(12-13-22(23)32-18-19-8-4-2-5-9-19)17-27-24(29)14-15-26-25(30)28-21-10-6-3-7-11-21/h2,4-5,8-9,12-13,16,21H,3,6-7,10-11,14-15,17-18H2,1H3,(H,27,29)(H2,26,28,30)