methyl 3-[[3-(1-pentylpiperidin-4-yl)-1-benzofuran-5-yl]carbamoylamino]benzoate

Systemtic Name: methyl 3-[[3-(1-pentylpiperidin-4-yl)-1-benzofuran-5-yl]carbamoylamino]benzoate Openeye Name: methyl 3-[[3-(1-pentyl-4-piperidyl)benzofuran-5-yl]carbamoylamino]benzoate CAS Name: 3-[[oxo-[[3-(1-pentyl-4-piperidinyl)-5-benzofuranyl]amino]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[3-(1-pentylpiperidin-4-yl)-1-benzofuran-5-yl]carbamoylamino]benzoate Traditional Name: 3-[[3-(1-amyl-4-piperidyl)benzofuran-5-yl]carbamoylamino]benzoic acid methyl ester Formula: C27H33N3O4 MolecularWeight: 463.56862

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1CCC(CC1)C2=COC3=C2C=C(C=C3)NC(=O)NC4=CC=CC(=C4)C(=O)OC

Isomeric SMILES

CCCCCN1CCC(CC1)C2=COC3=C2C=C(C=C3)NC(=O)NC4=CC=CC(=C4)C(=O)OC

InChI

InChI=1S/C27H33N3O4/c1-3-4-5-13-30-14-11-19(12-15-30)24-18-34-25-10-9-22(17-23(24)25)29-27(32)28-21-8-6-7-20(16-21)26(31)33-2/h6-10,16-19H,3-5,11-15H2,1-2H3,(H2,28,29,32)