(E)-N-[3-(4-ethylpiperazin-1-yl)sulfonylphenyl]-3-(3-nitrophenyl)prop-2-enamide

Systemtic Name: (E)-N-[3-(4-ethylpiperazin-1-yl)sulfonylphenyl]-3-(3-nitrophenyl)prop-2-enamide Openeye Name: (E)-N-[3-(4-ethylpiperazin-1-yl)sulfonylphenyl]-3-(3-nitrophenyl)prop-2-enamide CAS Name: (E)-N-[3-[(4-ethyl-1-piperazinyl)sulfonyl]phenyl]-3-(3-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-[3-(4-ethylpiperazin-1-yl)sulfonylphenyl]-3-(3-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-[3-(4-ethylpiperazino)sulfonylphenyl]-3-(3-nitrophenyl)acrylamide Formula: C21H24N4O5S MolecularWeight: 444.50406

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C=CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCN1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)/C=C/C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H24N4O5S/c1-2-23-11-13-24(14-12-23)31(29,30)20-8-4-6-18(16-20)22-21(26)10-9-17-5-3-7-19(15-17)25(27)28/h3-10,15-16H,2,11-14H2,1H3,(H,22,26)/b10-9+