methyl 4-[(4-chloranyl-2-nitro-phenyl)amino]-3-methyl-piperidine-1-carboxylate

Systemtic Name: methyl 4-[(4-chloranyl-2-nitro-phenyl)amino]-3-methyl-piperidine-1-carboxylate Openeye Name: methyl 4-(4-chloro-2-nitro-anilino)-3-methyl-piperidine-1-carboxylate CAS Name: 4-(4-chloro-2-nitroanilino)-3-methyl-1-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-chloro-2-nitroanilino)-3-methylpiperidine-1-carboxylate Traditional Name: 4-(4-chloro-2-nitro-anilino)-3-methyl-piperidine-1-carboxylic acid methyl ester Formula: C14H18ClN3O4 MolecularWeight: 327.76342

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCC1NC2=C(C=C(C=C2)Cl)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1CN(CCC1NC2=C(C=C(C=C2)Cl)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C14H18ClN3O4/c1-9-8-17(14(19)22-2)6-5-11(9)16-12-4-3-10(15)7-13(12)18(20)21/h3-4,7,9,11,16H,5-6,8H2,1-2H3