methyl 4-[[2-(1-methylpyrrol-2-yl)-2-morpholin-4-yl-ethyl]carbamoyl]benzoate

Systemtic Name: methyl 4-[[2-(1-methylpyrrol-2-yl)-2-morpholin-4-yl-ethyl]carbamoyl]benzoate Openeye Name: methyl 4-[[2-(1-methylpyrrol-2-yl)-2-morpholino-ethyl]carbamoyl]benzoate CAS Name: 4-[[[2-(1-methyl-2-pyrrolyl)-2-(4-morpholinyl)ethyl]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(1-methylpyrrol-2-yl)-2-morpholin-4-ylethyl]carbamoyl]benzoate Traditional Name: 4-[[2-(1-methylpyrrol-2-yl)-2-morpholino-ethyl]carbamoyl]benzoic acid methyl ester Formula: C20H25N3O4 MolecularWeight: 371.4302

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(CNC(=O)C2=CC=C(C=C2)C(=O)OC)N3CCOCC3

Isomeric SMILES

CN1C=CC=C1C(CNC(=O)C2=CC=C(C=C2)C(=O)OC)N3CCOCC3

InChI

InChI=1S/C20H25N3O4/c1-22-9-3-4-17(22)18(23-10-12-27-13-11-23)14-21-19(24)15-5-7-16(8-6-15)20(25)26-2/h3-9,18H,10-14H2,1-2H3,(H,21,24)