N-[2-[[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-2-chloranyl-4-nitro-N-propyl-benzamide

Systemtic Name: N-[2-[[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-2-chloranyl-4-nitro-N-propyl-benzamide Openeye Name: N-[2-[[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]amino]-2-oxo-ethyl]-2-chloro-4-nitro-N-propyl-benzamide CAS Name: N-[2-[[5-tert-butyl-2-(4-methoxyphenyl)-3-pyrazolyl]amino]-2-oxoethyl]-2-chloro-4-nitro-N-propylbenzamide IUPAC Name: N-[2-[[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]amino]-2-oxoethyl]-2-chloro-4-nitro-N-propylbenzamide Traditional Name: N-[2-[[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]amino]-2-keto-ethyl]-2-chloro-4-nitro-N-propyl-benzamide Formula: C26H30ClN5O5 MolecularWeight: 527.9999

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC(=O)NC1=CC(=NN1C2=CC=C(C=C2)OC)C(C)(C)C)C(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CCCN(CC(=O)NC1=CC(=NN1C2=CC=C(C=C2)OC)C(C)(C)C)C(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C26H30ClN5O5/c1-6-13-30(25(34)20-12-9-18(32(35)36)14-21(20)27)16-24(33)28-23-15-22(26(2,3)4)29-31(23)17-7-10-19(37-5)11-8-17/h7-12,14-15H,6,13,16H2,1-5H3,(H,28,33)