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

Systemtic Name: methyl 4-[2-aminocarbonyl-3-[3-(1-azanylethenylamino)propyl]-4-oxidanylidene-azetidin-1-yl]carbonylpiperazine-1-carboxylate Openeye Name: methyl 4-[3-[3-(1-aminovinylamino)propyl]-2-carbamoyl-4-oxo-azetidine-1-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[3-[3-(1-aminoethenylamino)propyl]-2-carbamoyl-4-oxo-1-azetidinyl]-oxomethyl]-1-piperazinecarboxylic acid methyl ester IUPAC Name: methyl 4-[3-[3-(1-aminoethenylamino)propyl]-2-carbamoyl-4-oxoazetidine-1-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[3-[3-(1-aminovinylamino)propyl]-2-carbamoyl-4-keto-azetidine-1-carbonyl]piperazine-1-carboxylic acid methyl ester Formula: C16H26N6O5 MolecularWeight: 382.41484

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CCN(CC1)C(=O)N2C(C(C2=O)CCCNC(=C)N)C(=O)N

Isomeric SMILES

COC(=O)N1CCN(CC1)C(=O)N2C(C(C2=O)CCCNC(=C)N)C(=O)N

InChI

InChI=1S/C16H26N6O5/c1-10(17)19-5-3-4-11-12(13(18)23)22(14(11)24)15(25)20-6-8-21(9-7-20)16(26)27-2/h11-12,19H,1,3-9,17H2,2H3,(H2,18,23)