O4-[2-(1-adamantylmethylamino)-2-oxidanylidene-ethyl] O1-ethyl (E)-but-2-enedioate

Systemtic Name: O4-[2-(1-adamantylmethylamino)-2-oxidanylidene-ethyl] O1-ethyl (E)-but-2-enedioate Openeye Name: O4-[2-(1-adamantylmethylamino)-2-oxo-ethyl] O1-ethyl (E)-but-2-enedioate CAS Name: (E)-2-butenedioic acid O4-[2-(1-adamantylmethylamino)-2-oxoethyl] ester O1-ethyl ester IUPAC Name: 4-O-[2-(1-adamantylmethylamino)-2-oxoethyl] 1-O-ethyl (E)-but-2-enedioate Traditional Name: (E)-but-2-enedioic acid O4-[2-(1-adamantylmethylamino)-2-keto-ethyl] ester O1-ethyl ester Formula: C19H27NO5 MolecularWeight: 349.42138

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(=O)OCC(=O)NCC12CC3CC(C1)CC(C3)C2

Isomeric SMILES

CCOC(=O)/C=C/C(=O)OCC(=O)NCC12CC3CC(C1)CC(C3)C2

InChI

InChI=1S/C19H27NO5/c1-2-24-17(22)3-4-18(23)25-11-16(21)20-12-19-8-13-5-14(9-19)7-15(6-13)10-19/h3-4,13-15H,2,5-12H2,1H3,(H,20,21)/b4-3+