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

Systemtic Name: (E)-N-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]-3-(3-nitrophenyl)prop-2-enamide Openeye Name: (E)-N-[4-[(3-methyl-1-piperidyl)sulfonyl]phenyl]-3-(3-nitrophenyl)prop-2-enamide CAS Name: (E)-N-[4-[(3-methyl-1-piperidinyl)sulfonyl]phenyl]-3-(3-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]-3-(3-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-[4-(3-methylpiperidino)sulfonylphenyl]-3-(3-nitrophenyl)acrylamide Formula: C21H23N3O5S MolecularWeight: 429.48942

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C=CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)/C=C/C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H23N3O5S/c1-16-4-3-13-23(15-16)30(28,29)20-10-8-18(9-11-20)22-21(25)12-7-17-5-2-6-19(14-17)24(26)27/h2,5-12,14,16H,3-4,13,15H2,1H3,(H,22,25)/b12-7+