ethyl 4-methylidene-2-oxidanylidene-6-[4-(2-oxidanylidene-2-piperidin-1-yl-ethoxy)phenyl]-1,3-diazinane-5-carboxylate

Systemtic Name: ethyl 4-methylidene-2-oxidanylidene-6-[4-(2-oxidanylidene-2-piperidin-1-yl-ethoxy)phenyl]-1,3-diazinane-5-carboxylate Openeye Name: ethyl 4-methylene-2-oxo-6-[4-[2-oxo-2-(1-piperidyl)ethoxy]phenyl]hexahydropyrimidine-5-carboxylate CAS Name: 4-methylene-2-oxo-6-[4-[2-oxo-2-(1-piperidinyl)ethoxy]phenyl]-1,3-diazinane-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-methylidene-2-oxo-6-[4-(2-oxo-2-piperidin-1-ylethoxy)phenyl]-1,3-diazinane-5-carboxylate Traditional Name: 2-keto-4-[4-(2-keto-2-piperidino-ethoxy)phenyl]-6-methylene-hexahydropyrimidine-5-carboxylic acid ethyl ester Formula: C21H27N3O5 MolecularWeight: 401.45618

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(NC(=O)NC1=C)C2=CC=C(C=C2)OCC(=O)N3CCCCC3

Isomeric SMILES

CCOC(=O)C1C(NC(=O)NC1=C)C2=CC=C(C=C2)OCC(=O)N3CCCCC3

InChI

InChI=1S/C21H27N3O5/c1-3-28-20(26)18-14(2)22-21(27)23-19(18)15-7-9-16(10-8-15)29-13-17(25)24-11-5-4-6-12-24/h7-10,18-19H,2-6,11-13H2,1H3,(H2,22,23,27)