ethyl 3-[3-(1-azanylethenylamino)propyl]-1-[4-(tert-butylcarbamoyl)piperazin-1-yl]carbonyl-4-oxidanylidene-azetidine-2-carboxylate

Systemtic Name: ethyl 3-[3-(1-azanylethenylamino)propyl]-1-[4-(tert-butylcarbamoyl)piperazin-1-yl]carbonyl-4-oxidanylidene-azetidine-2-carboxylate Openeye Name: ethyl 3-[3-(1-aminovinylamino)propyl]-1-[4-(tert-butylcarbamoyl)piperazine-1-carbonyl]-4-oxo-azetidine-2-carboxylate CAS Name: 3-[3-(1-aminoethenylamino)propyl]-1-[[4-[(tert-butylamino)-oxomethyl]-1-piperazinyl]-oxomethyl]-4-oxo-2-azetidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[3-(1-aminoethenylamino)propyl]-1-[4-(tert-butylcarbamoyl)piperazine-1-carbonyl]-4-oxoazetidine-2-carboxylate Traditional Name: 3-[3-(1-aminovinylamino)propyl]-1-[4-(tert-butylcarbamoyl)piperazine-1-carbonyl]-4-keto-azetidine-2-carboxylic acid ethyl ester Formula: C21H36N6O5 MolecularWeight: 452.54774

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(C(=O)N1C(=O)N2CCN(CC2)C(=O)NC(C)(C)C)CCCNC(=C)N

Isomeric SMILES

CCOC(=O)C1C(C(=O)N1C(=O)N2CCN(CC2)C(=O)NC(C)(C)C)CCCNC(=C)N

InChI

InChI=1S/C21H36N6O5/c1-6-32-18(29)16-15(8-7-9-23-14(2)22)17(28)27(16)20(31)26-12-10-25(11-13-26)19(30)24-21(3,4)5/h15-16,23H,2,6-13,22H2,1,3-5H3,(H,24,30)