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(E)-N-[[4-(diethylaminomethyl)phenyl]methyl]-3-(3-nitrophenyl)prop-2-enamide
(E)-N-[[4-(diethylaminomethyl)phenyl]methyl]-3-(3-nitrophenyl)prop-2-enamide
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Descriptors Computed from Structure
Canonical SMILES:
CCN(CC)CC1=CC=C(C=C1)CNC(=O)C=CC2=CC(=CC=C2)[N+](=O)[O-]
Isomeric SMILES
CCN(CC)CC1=CC=C(C=C1)CNC(=O)/C=C/C2=CC(=CC=C2)[N+](=O)[O-]
InChI
InChI=1S/C21H25N3O3/c1-3-23(4-2)16-19-10-8-18(9-11-19)15-22-21(25)13-12-17-6-5-7-20(14-17)24(26)27/h5-14H,3-4,15-16H2,1-2H3,(H,22,25)/b13-12+
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