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

Systemtic Name: 1-(3-azanylazetidin-1-yl)carbonyl-3-[3-(1-azanylethenylamino)propyl]-4-oxidanylidene-azetidine-2-carboxylic acid Openeye Name: 1-(3-aminoazetidine-1-carbonyl)-3-[3-(1-aminovinylamino)propyl]-4-oxo-azetidine-2-carboxylic acid CAS Name: 1-[(3-amino-1-azetidinyl)-oxomethyl]-3-[3-(1-aminoethenylamino)propyl]-4-oxo-2-azetidinecarboxylic acid IUPAC Name: 1-(3-aminoazetidine-1-carbonyl)-3-[3-(1-aminoethenylamino)propyl]-4-oxoazetidine-2-carboxylic acid Traditional Name: 1-(3-aminoazetidine-1-carbonyl)-3-[3-(1-aminovinylamino)propyl]-4-keto-azetidine-2-carboxylic acid Formula: C13H21N5O4 MolecularWeight: 311.33694

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Descriptors Computed from Structure

Canonical SMILES:

C=C(N)NCCCC1C(N(C1=O)C(=O)N2CC(C2)N)C(=O)O

Isomeric SMILES

C=C(N)NCCCC1C(N(C1=O)C(=O)N2CC(C2)N)C(=O)O

InChI

InChI=1S/C13H21N5O4/c1-7(14)16-4-2-3-9-10(12(20)21)18(11(9)19)13(22)17-5-8(15)6-17/h8-10,16H,1-6,14-15H2,(H,20,21)