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4-ethoxy-3-nitro-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]benzamide
4-ethoxy-3-nitro-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]benzamide
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Descriptors Computed from Structure
Canonical SMILES:
CCOC1=C(C=C(C=C1)C(=O)NCC2=CC=C(C=C2)CN3CCCC3)[N+](=O)[O-]
Isomeric SMILES
CCOC1=C(C=C(C=C1)C(=O)NCC2=CC=C(C=C2)CN3CCCC3)[N+](=O)[O-]
InChI
InChI=1S/C21H25N3O4/c1-2-28-20-10-9-18(13-19(20)24(26)27)21(25)22-14-16-5-7-17(8-6-16)15-23-11-3-4-12-23/h5-10,13H,2-4,11-12,14-15H2,1H3,(H,22,25)
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