N-[(4-ethylphenyl)methyl]-N-methyl-3-nitro-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-[(4-ethylphenyl)methyl]-N-methyl-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-[(4-ethylphenyl)methyl]-N-methyl-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-[(4-ethylphenyl)methyl]-N-methyl-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-[(4-ethylphenyl)methyl]-N-methyl-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-(4-ethylbenzyl)-N-methyl-3-nitro-4-pyrrolidino-benzamide Formula: C21H25N3O3 MolecularWeight: 367.4415

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN(C)C(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)CN(C)C(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C21H25N3O3/c1-3-16-6-8-17(9-7-16)15-22(2)21(25)18-10-11-19(20(14-18)24(26)27)23-12-4-5-13-23/h6-11,14H,3-5,12-13,15H2,1-2H3