5-[[azanyl(nitramido)methylidene]amino]-2-[(6-methylnaphthalen-1-yl)sulfonylamino]pentanoic acid

Systemtic Name: 5-[[azanyl(nitramido)methylidene]amino]-2-[(6-methylnaphthalen-1-yl)sulfonylamino]pentanoic acid Openeye Name: 5-[[amino(nitramido)methylene]amino]-2-[(6-methyl-1-naphthyl)sulfonylamino]pentanoic acid CAS Name: 5-[[amino(nitramido)methylidene]amino]-2-[(6-methyl-1-naphthalenyl)sulfonylamino]pentanoic acid IUPAC Name: 5-[[amino(nitramido)methylidene]amino]-2-[(6-methylnaphthalen-1-yl)sulfonylamino]pentanoic acid Traditional Name: 5-[[amino(nitramido)methylene]amino]-2-[(6-methyl-1-naphthyl)sulfonylamino]valeric acid Formula: C17H21N5O6S MolecularWeight: 423.44354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC=C2)S(=O)(=O)NC(CCCN=C(N)N[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC=C2)S(=O)(=O)NC(CCCN=C(N)N[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C17H21N5O6S/c1-11-7-8-13-12(10-11)4-2-6-15(13)29(27,28)21-14(16(23)24)5-3-9-19-17(18)20-22(25)26/h2,4,6-8,10,14,21H,3,5,9H2,1H3,(H,23,24)(H3,18,19,20)