methyl 2-[(4-chloranyl-2-nitro-phenoxy)methyl]-4-methyl-quinoline-3-carboxylate

Systemtic Name: methyl 2-[(4-chloranyl-2-nitro-phenoxy)methyl]-4-methyl-quinoline-3-carboxylate Openeye Name: methyl 2-[(4-chloro-2-nitro-phenoxy)methyl]-4-methyl-quinoline-3-carboxylate CAS Name: 2-[(4-chloro-2-nitrophenoxy)methyl]-4-methyl-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[(4-chloro-2-nitrophenoxy)methyl]-4-methylquinoline-3-carboxylate Traditional Name: 2-[(4-chloro-2-nitro-phenoxy)methyl]-4-methyl-quinoline-3-carboxylic acid methyl ester Formula: C19H15ClN2O5 MolecularWeight: 386.7858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)COC3=C(C=C(C=C3)Cl)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)COC3=C(C=C(C=C3)Cl)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C19H15ClN2O5/c1-11-13-5-3-4-6-14(13)21-15(18(11)19(23)26-2)10-27-17-8-7-12(20)9-16(17)22(24)25/h3-9H,10H2,1-2H3