ethyl 4-[3-[3-(1-azanylethenylamino)propyl]-2-(methylcarbamoyl)-4-oxidanylidene-azetidin-1-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[3-[3-(1-azanylethenylamino)propyl]-2-(methylcarbamoyl)-4-oxidanylidene-azetidin-1-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[3-[3-(1-aminovinylamino)propyl]-2-(methylcarbamoyl)-4-oxo-azetidine-1-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[3-[3-(1-aminoethenylamino)propyl]-2-(methylcarbamoyl)-4-oxo-1-azetidinyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-[3-(1-aminoethenylamino)propyl]-2-(methylcarbamoyl)-4-oxoazetidine-1-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[3-[3-(1-aminovinylamino)propyl]-2-keto-4-(methylcarbamoyl)azetidine-1-carbonyl]piperazine-1-carboxylic acid ethyl ester Formula: C18H30N6O5 MolecularWeight: 410.468

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)N2C(C(C2=O)CCCNC(=C)N)C(=O)NC

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)N2C(C(C2=O)CCCNC(=C)N)C(=O)NC

InChI

InChI=1S/C18H30N6O5/c1-4-29-18(28)23-10-8-22(9-11-23)17(27)24-14(15(25)20-3)13(16(24)26)6-5-7-21-12(2)19/h13-14,21H,2,4-11,19H2,1,3H3,(H,20,25)