2-chloranyl-N-(2,6-dimethylphenyl)-N-(pyrazol-1-ylmethyl)ethanamide; 3,4-dimethyl-2,6-dinitro-N-pentan-3-yl-aniline

Systemtic Name: 2-chloranyl-N-(2,6-dimethylphenyl)-N-(pyrazol-1-ylmethyl)ethanamide; 3,4-dimethyl-2,6-dinitro-N-pentan-3-yl-aniline Openeye Name: 2-chloro-N-(2,6-dimethylphenyl)-N-(pyrazol-1-ylmethyl)acetamide; N-(1-ethylpropyl)-3,4-dimethyl-2,6-dinitro-aniline CAS Name: 2-chloro-N-(2,6-dimethylphenyl)-N-(1-pyrazolylmethyl)acetamide; 3,4-dimethyl-2,6-dinitro-N-pentan-3-ylaniline IUPAC Name: 2-chloro-N-(2,6-dimethylphenyl)-N-(pyrazol-1-ylmethyl)acetamide; 3,4-dimethyl-2,6-dinitro-N-pentan-3-ylaniline Traditional Name: 2-chloro-N-(2,6-dimethylphenyl)-N-(pyrazol-1-ylmethyl)acetamide; (3,4-dimethyl-2,6-dinitro-phenyl)-(1-ethylpropyl)amine Formula: C27H35ClN6O5 MolecularWeight: 559.057

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC1=C(C=C(C(=C1[N+](=O)[O-])C)C)[N+](=O)[O-].CC1=C(C(=CC=C1)C)N(CN2C=CC=N2)C(=O)CCl

Isomeric SMILES

CCC(CC)NC1=C(C=C(C(=C1[N+](=O)[O-])C)C)[N+](=O)[O-].CC1=C(C(=CC=C1)C)N(CN2C=CC=N2)C(=O)CCl

InChI

InChI=1S/C14H16ClN3O.C13H19N3O4/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17;1-5-10(6-2)14-12-11(15(17)18)7-8(3)9(4)13(12)16(19)20/h3-8H,9-10H2,1-2H3;7,10,14H,5-6H2,1-4H3