methyl 3-[[1-[3-[(3-methoxyphenyl)carbamoylamino]propyl]piperidin-4-yl]methyl]benzoate

Systemtic Name: methyl 3-[[1-[3-[(3-methoxyphenyl)carbamoylamino]propyl]piperidin-4-yl]methyl]benzoate Openeye Name: methyl 3-[[1-[3-[(3-methoxyphenyl)carbamoylamino]propyl]-4-piperidyl]methyl]benzoate CAS Name: 3-[[1-[3-[[(3-methoxyanilino)-oxomethyl]amino]propyl]-4-piperidinyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[[1-[3-[(3-methoxyphenyl)carbamoylamino]propyl]piperidin-4-yl]methyl]benzoate Traditional Name: 3-[[1-[3-[(3-methoxyphenyl)carbamoylamino]propyl]-4-piperidyl]methyl]benzoic acid methyl ester Formula: C25H33N3O4 MolecularWeight: 439.54722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)NCCCN2CCC(CC2)CC3=CC=CC(=C3)C(=O)OC

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)NCCCN2CCC(CC2)CC3=CC=CC(=C3)C(=O)OC

InChI

InChI=1S/C25H33N3O4/c1-31-23-9-4-8-22(18-23)27-25(30)26-12-5-13-28-14-10-19(11-15-28)16-20-6-3-7-21(17-20)24(29)32-2/h3-4,6-9,17-19H,5,10-16H2,1-2H3,(H2,26,27,30)