1-[2,5-bis(azanyl)pentanoyl]-1-phenylmethoxycarbonyl-pyrrolidin-1-ium-2-carboxylic acid

Systemtic Name: 1-[2,5-bis(azanyl)pentanoyl]-1-phenylmethoxycarbonyl-pyrrolidin-1-ium-2-carboxylic acid Openeye Name: 1-benzyloxycarbonyl-1-(2,5-diaminopentanoyl)pyrrolidin-1-ium-2-carboxylic acid CAS Name: 1-(2,5-diamino-1-oxopentyl)-1-phenylmethoxycarbonyl-2-pyrrolidin-1-iumcarboxylic acid IUPAC Name: 1-(2,5-diaminopentanoyl)-1-phenylmethoxycarbonylpyrrolidin-1-ium-2-carboxylic acid Traditional Name: 1-carbobenzoxy-1-(2,5-diaminopentanoyl)pyrrolidin-1-ium-2-carboxylic acid Formula: C18H26N3O5+ MolecularWeight: 364.41614

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([N+](C1)(C(=O)C(CCCN)N)C(=O)OCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

C1CC([N+](C1)(C(=O)C(CCCN)N)C(=O)OCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C18H25N3O5/c19-10-4-8-14(20)16(22)21(11-5-9-15(21)17(23)24)18(25)26-12-13-6-2-1-3-7-13/h1-3,6-7,14-15H,4-5,8-12,19-20H2/p+1