3-[3-(1-azanylethenylamino)propyl]-1-(4-methoxycarbonylpiperazin-1-yl)carbonyl-4-oxidanylidene-azetidine-2-carboxylic acid

Systemtic Name: 3-[3-(1-azanylethenylamino)propyl]-1-(4-methoxycarbonylpiperazin-1-yl)carbonyl-4-oxidanylidene-azetidine-2-carboxylic acid Openeye Name: 3-[3-(1-aminovinylamino)propyl]-1-(4-methoxycarbonylpiperazine-1-carbonyl)-4-oxo-azetidine-2-carboxylic acid CAS Name: 3-[3-(1-aminoethenylamino)propyl]-1-[(4-methoxycarbonyl-1-piperazinyl)-oxomethyl]-4-oxo-2-azetidinecarboxylic acid IUPAC Name: 3-[3-(1-aminoethenylamino)propyl]-1-(4-methoxycarbonylpiperazine-1-carbonyl)-4-oxoazetidine-2-carboxylic acid Traditional Name: 3-[3-(1-aminovinylamino)propyl]-1-(4-carbomethoxypiperazine-1-carbonyl)-4-keto-azetidine-2-carboxylic acid Formula: C16H25N5O6 MolecularWeight: 383.3996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25N5O6/c1-10(17)18-5-3-4-11-12(14(23)24)21(13(11)22)15(25)19-6-8-20(9-7-19)16(26)27-2/h11-12,18H,1,3-9,17H2,2H3,(H,23,24)