3-nitro-N-(quinolin-2-ylmethyl)aniline

Systemtic Name: 3-nitro-N-(quinolin-2-ylmethyl)aniline Openeye Name: 3-nitro-N-(2-quinolylmethyl)aniline CAS Name: 3-nitro-N-(2-quinolinylmethyl)aniline IUPAC Name: 3-nitro-N-(quinolin-2-ylmethyl)aniline Traditional Name: (3-nitrophenyl)-(2-quinolylmethyl)amine Formula: C16H13N3O2 MolecularWeight: 279.29332

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13N3O2/c20-19(21)15-6-3-5-13(10-15)17-11-14-9-8-12-4-1-2-7-16(12)18-14/h1-10,17H,11H2