ethyl 4-[3-(diethylamino)propanoylamino]-2-oxidanyl-benzoate; iodanylmethane

Systemtic Name: ethyl 4-[3-(diethylamino)propanoylamino]-2-oxidanyl-benzoate; iodanylmethane Openeye Name: ethyl 4-[3-(diethylamino)propanoylamino]-2-hydroxy-benzoate; iodomethane CAS Name: 4-[[3-(diethylamino)-1-oxopropyl]amino]-2-hydroxybenzoic acid ethyl ester; iodomethane IUPAC Name: ethyl 4-[3-(diethylamino)propanoylamino]-2-hydroxybenzoate; iodomethane Traditional Name: 4-[3-(diethylamino)propanoylamino]-2-hydroxy-benzoic acid ethyl ester; iodomethane Formula: C17H27IN2O4 MolecularWeight: 450.31175

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCC(=O)NC1=CC(=C(C=C1)C(=O)OCC)O.CI

Isomeric SMILES

CCN(CC)CCC(=O)NC1=CC(=C(C=C1)C(=O)OCC)O.CI

InChI

InChI=1S/C16H24N2O4.CH3I/c1-4-18(5-2)10-9-15(20)17-12-7-8-13(14(19)11-12)16(21)22-6-3;1-2/h7-8,11,19H,4-6,9-10H2,1-3H3,(H,17,20);1H3