N-[(2-chloranylquinolin-3-yl)methyl]-3-nitro-aniline

Systemtic Name: N-[(2-chloranylquinolin-3-yl)methyl]-3-nitro-aniline Openeye Name: N-[(2-chloro-3-quinolyl)methyl]-3-nitro-aniline CAS Name: N-[(2-chloro-3-quinolinyl)methyl]-3-nitroaniline IUPAC Name: N-[(2-chloroquinolin-3-yl)methyl]-3-nitroaniline Traditional Name: (2-chloro-3-quinolyl)methyl-(3-nitrophenyl)amine Formula: C16H12ClN3O2 MolecularWeight: 313.73838

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=N2)Cl)CNC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=N2)Cl)CNC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H12ClN3O2/c17-16-12(8-11-4-1-2-7-15(11)19-16)10-18-13-5-3-6-14(9-13)20(21)22/h1-9,18H,10H2