quinolin-8-ylmethyl 3-methyl-4-nitro-benzoate

Systemtic Name: quinolin-8-ylmethyl 3-methyl-4-nitro-benzoate Openeye Name: 8-quinolylmethyl 3-methyl-4-nitro-benzoate CAS Name: 3-methyl-4-nitrobenzoic acid 8-quinolinylmethyl ester IUPAC Name: quinolin-8-ylmethyl 3-methyl-4-nitrobenzoate Traditional Name: 3-methyl-4-nitro-benzoic acid 8-quinolylmethyl ester Formula: C18H14N2O4 MolecularWeight: 322.31476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)OCC2=CC=CC3=C2N=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)OCC2=CC=CC3=C2N=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H14N2O4/c1-12-10-14(7-8-16(12)20(22)23)18(21)24-11-15-5-2-4-13-6-3-9-19-17(13)15/h2-10H,11H2,1H3