5-[[azanyl(nitramido)methylidene]amino]-2-[(phenylmethyl)amino]pentanoic acid

Systemtic Name: 5-[[azanyl(nitramido)methylidene]amino]-2-[(phenylmethyl)amino]pentanoic acid Openeye Name: 5-[[amino(nitramido)methylene]amino]-2-(benzylamino)pentanoic acid CAS Name: 5-[[amino(nitramido)methylidene]amino]-2-[(phenylmethyl)amino]pentanoic acid IUPAC Name: 5-[[amino(nitramido)methylidene]amino]-2-(benzylamino)pentanoic acid Traditional Name: 5-[[amino(nitramido)methylene]amino]-2-(benzylamino)valeric acid Formula: C13H19N5O4 MolecularWeight: 309.32106

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(CCCN=C(N)N[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CNC(CCCN=C(N)N[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C13H19N5O4/c14-13(17-18(21)22)15-8-4-7-11(12(19)20)16-9-10-5-2-1-3-6-10/h1-3,5-6,11,16H,4,7-9H2,(H,19,20)(H3,14,15,17)