1-(3-nitroquinolin-4-yl)-2-(phenylmethyl)guanidine

Systemtic Name: 1-(3-nitroquinolin-4-yl)-2-(phenylmethyl)guanidine Openeye Name: 2-benzyl-1-(3-nitro-4-quinolyl)guanidine CAS Name: 1-(3-nitro-4-quinolinyl)-2-(phenylmethyl)guanidine IUPAC Name: 2-benzyl-1-(3-nitroquinolin-4-yl)guanidine Traditional Name: 2-benzyl-1-(3-nitro-4-quinolyl)guanidine Formula: C17H15N5O2 MolecularWeight: 321.3333

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN=C(N)NC2=C(C=NC3=CC=CC=C32)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CN=C(N)NC2=C(C=NC3=CC=CC=C32)[N+](=O)[O-]

InChI

InChI=1S/C17H15N5O2/c18-17(20-10-12-6-2-1-3-7-12)21-16-13-8-4-5-9-14(13)19-11-15(16)22(23)24/h1-9,11H,10H2,(H3,18,19,20,21)