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

Systemtic Name: 3-[3-(1-azanylethenylamino)propyl]-1-(4-ethoxycarbonylpiperazin-1-yl)carbonyl-4-oxidanylidene-azetidine-2-carboxylic acid Openeye Name: 3-[3-(1-aminovinylamino)propyl]-1-(4-ethoxycarbonylpiperazine-1-carbonyl)-4-oxo-azetidine-2-carboxylic acid CAS Name: 3-[3-(1-aminoethenylamino)propyl]-1-[(4-ethoxycarbonyl-1-piperazinyl)-oxomethyl]-4-oxo-2-azetidinecarboxylic acid IUPAC Name: 3-[3-(1-aminoethenylamino)propyl]-1-(4-ethoxycarbonylpiperazine-1-carbonyl)-4-oxoazetidine-2-carboxylic acid Traditional Name: 3-[3-(1-aminovinylamino)propyl]-1-(4-carbethoxypiperazine-1-carbonyl)-4-keto-azetidine-2-carboxylic acid Formula: C17H27N5O6 MolecularWeight: 397.42618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H27N5O6/c1-3-28-17(27)21-9-7-20(8-10-21)16(26)22-13(15(24)25)12(14(22)23)5-4-6-19-11(2)18/h12-13,19H,2-10,18H2,1H3,(H,24,25)