1-[azanyl(4-azanylbutyl)carbamoyl]-2-(6-azanyl-1-oxidanyl-1-oxidanylidene-hexan-2-yl)pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[azanyl(4-azanylbutyl)carbamoyl]-2-(6-azanyl-1-oxidanyl-1-oxidanylidene-hexan-2-yl)pyrrolidine-2-carboxylic acid Openeye Name: 1-[amino(4-aminobutyl)carbamoyl]-2-(5-amino-1-carboxy-pentyl)pyrrolidine-2-carboxylic acid CAS Name: 1-[[amino(4-aminobutyl)amino]-oxomethyl]-2-(6-amino-1-hydroxy-1-oxohexan-2-yl)-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[amino(4-aminobutyl)carbamoyl]-2-(6-amino-1-hydroxy-1-oxohexan-2-yl)pyrrolidine-2-carboxylic acid Traditional Name: 1-[amino(4-aminobutyl)carbamoyl]-2-(5-amino-1-carboxy-pentyl)proline Formula: C16H31N5O5 MolecularWeight: 373.44784

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)N(CCCCN)N)(C(CCCCN)C(=O)O)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(=O)N(CCCCN)N)(C(CCCCN)C(=O)O)C(=O)O

InChI

InChI=1S/C16H31N5O5/c17-8-2-1-6-12(13(22)23)16(14(24)25)7-5-10-20(16)15(26)21(19)11-4-3-9-18/h12H,1-11,17-19H2,(H,22,23)(H,24,25)