3-[2-[4-[3-[bis(azanyl)methylideneamino]propyl]-2,5-bis(oxidanylidene)imidazolidin-1-yl]ethanoylamino]-2-(phenylmethoxycarbonylamino)propanoic acid

Systemtic Name: 3-[2-[4-[3-[bis(azanyl)methylideneamino]propyl]-2,5-bis(oxidanylidene)imidazolidin-1-yl]ethanoylamino]-2-(phenylmethoxycarbonylamino)propanoic acid Openeye Name: 2-(benzyloxycarbonylamino)-3-[[2-[4-(3-guanidinopropyl)-2,5-dioxo-imidazolidin-1-yl]acetyl]amino]propanoic acid CAS Name: 3-[[2-[4-[3-(diaminomethylideneamino)propyl]-2,5-dioxo-1-imidazolidinyl]-1-oxoethyl]amino]-2-(phenylmethoxycarbonylamino)propanoic acid IUPAC Name: 3-[[2-[4-[3-(diaminomethylideneamino)propyl]-2,5-dioxoimidazolidin-1-yl]acetyl]amino]-2-(phenylmethoxycarbonylamino)propanoic acid Traditional Name: 2-(benzyloxycarbonylamino)-3-[[2-[4-(3-guanidinopropyl)-2,5-diketo-imidazolidin-1-yl]acetyl]amino]propionic acid Formula: C20H27N7O7 MolecularWeight: 477.47108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CNC(=O)CN2C(=O)C(NC2=O)CCCN=C(N)N)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(CNC(=O)CN2C(=O)C(NC2=O)CCCN=C(N)N)C(=O)O

InChI

InChI=1S/C20H27N7O7/c21-18(22)23-8-4-7-13-16(29)27(19(32)25-13)10-15(28)24-9-14(17(30)31)26-20(33)34-11-12-5-2-1-3-6-12/h1-3,5-6,13-14H,4,7-11H2,(H,24,28)(H,25,32)(H,26,33)(H,30,31)(H4,21,22,23)