[2-(3-ethoxypropylcarbamoylamino)-2-oxidanylidene-ethyl] (5S,7S)-3-chloranyladamantane-1-carboxylate

Systemtic Name: [2-(3-ethoxypropylcarbamoylamino)-2-oxidanylidene-ethyl] (5S,7S)-3-chloranyladamantane-1-carboxylate Openeye Name: [2-(3-ethoxypropylcarbamoylamino)-2-oxo-ethyl] (5S,7S)-3-chloroadamantane-1-carboxylate CAS Name: (5S,7S)-3-chloro-1-adamantanecarboxylic acid [2-[[(3-ethoxypropylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(3-ethoxypropylcarbamoylamino)-2-oxoethyl] (5S,7S)-3-chloroadamantane-1-carboxylate Traditional Name: (5S,7S)-3-chloroadamantane-1-carboxylic acid [2-(3-ethoxypropylcarbamoylamino)-2-keto-ethyl] ester Formula: C19H29ClN2O5 MolecularWeight: 400.89696

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=O)NC(=O)COC(=O)C12CC3CC(C1)CC(C3)(C2)Cl

Isomeric SMILES

CCOCCCNC(=O)NC(=O)COC(=O)C12C[C@@H]3C[C@@H](C1)CC(C3)(C2)Cl

InChI

InChI=1S/C19H29ClN2O5/c1-2-26-5-3-4-21-17(25)22-15(23)11-27-16(24)18-7-13-6-14(8-18)10-19(20,9-13)12-18/h13-14H,2-12H2,1H3,(H2,21,22,23,25)/t13-,14-,18?,19?/m0/s1