methyl 4-[[2-[4-(cyclopropylcarbonylamino)piperidin-1-yl]propanoylamino]methyl]benzoate

Systemtic Name: methyl 4-[[2-[4-(cyclopropylcarbonylamino)piperidin-1-yl]propanoylamino]methyl]benzoate Openeye Name: methyl 4-[[2-[4-(cyclopropanecarbonylamino)-1-piperidyl]propanoylamino]methyl]benzoate CAS Name: 4-[[[2-[4-[[cyclopropyl(oxo)methyl]amino]-1-piperidinyl]-1-oxopropyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[4-(cyclopropanecarbonylamino)piperidin-1-yl]propanoylamino]methyl]benzoate Traditional Name: 4-[[2-[4-(cyclopropanecarbonylamino)piperidino]propanoylamino]methyl]benzoic acid methyl ester Formula: C21H29N3O4 MolecularWeight: 387.47266

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=C(C=C1)C(=O)OC)N2CCC(CC2)NC(=O)C3CC3

Isomeric SMILES

CC(C(=O)NCC1=CC=C(C=C1)C(=O)OC)N2CCC(CC2)NC(=O)C3CC3

InChI

InChI=1S/C21H29N3O4/c1-14(24-11-9-18(10-12-24)23-20(26)16-7-8-16)19(25)22-13-15-3-5-17(6-4-15)21(27)28-2/h3-6,14,16,18H,7-13H2,1-2H3,(H,22,25)(H,23,26)