N-[3-[[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]amino]-3-oxidanylidene-propyl]-4-nitro-benzamide

Systemtic Name: N-[3-[[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]amino]-3-oxidanylidene-propyl]-4-nitro-benzamide Openeye Name: N-[3-[[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]amino]-3-oxo-propyl]-4-nitro-benzamide CAS Name: N-[3-[[2-[(4-ethylphenyl)methyl]-3-pyrazolyl]amino]-3-oxopropyl]-4-nitrobenzamide IUPAC Name: N-[3-[[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]amino]-3-oxopropyl]-4-nitrobenzamide Traditional Name: N-[3-[[2-(4-ethylbenzyl)pyrazol-3-yl]amino]-3-keto-propyl]-4-nitro-benzamide Formula: C22H23N5O4 MolecularWeight: 421.44912

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)CCNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)CCNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H23N5O4/c1-2-16-3-5-17(6-4-16)15-26-20(11-14-24-26)25-21(28)12-13-23-22(29)18-7-9-19(10-8-18)27(30)31/h3-11,14H,2,12-13,15H2,1H3,(H,23,29)(H,25,28)