2-[2,6-bis(azanyl)hexanoylamino]-4-phenyl-butanoic acid

Systemtic Name: 2-[2,6-bis(azanyl)hexanoylamino]-4-phenyl-butanoic acid Openeye Name: 2-(2,6-diaminohexanoylamino)-4-phenyl-butanoic acid CAS Name: 2-[(2,6-diamino-1-oxohexyl)amino]-4-phenylbutanoic acid IUPAC Name: 2-(2,6-diaminohexanoylamino)-4-phenylbutanoic acid Traditional Name: 2-(2,6-diaminohexanoylamino)-4-phenyl-butyric acid Formula: C16H25N3O3 MolecularWeight: 307.388

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(C(=O)O)NC(=O)C(CCCCN)N

Isomeric SMILES

C1=CC=C(C=C1)CCC(C(=O)O)NC(=O)C(CCCCN)N

InChI

InChI=1S/C16H25N3O3/c17-11-5-4-8-13(18)15(20)19-14(16(21)22)10-9-12-6-2-1-3-7-12/h1-3,6-7,13-14H,4-5,8-11,17-18H2,(H,19,20)(H,21,22)