(E)-1-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-3-(4-nitrophenyl)prop-2-en-1-one

Systemtic Name: (E)-1-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-3-(4-nitrophenyl)prop-2-en-1-one Openeye Name: (E)-1-[4-[(4-methyl-1-piperidyl)sulfonyl]phenyl]-3-(4-nitrophenyl)prop-2-en-1-one CAS Name: (E)-1-[4-[(4-methyl-1-piperidinyl)sulfonyl]phenyl]-3-(4-nitrophenyl)-2-propen-1-one IUPAC Name: (E)-1-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-3-(4-nitrophenyl)prop-2-en-1-one Traditional Name: (E)-1-[4-(4-methylpiperidino)sulfonylphenyl]-3-(4-nitrophenyl)prop-2-en-1-one Formula: C21H22N2O5S MolecularWeight: 414.47478

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)C=CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)/C=C/C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H22N2O5S/c1-16-12-14-22(15-13-16)29(27,28)20-9-5-18(6-10-20)21(24)11-4-17-2-7-19(8-3-17)23(25)26/h2-11,16H,12-15H2,1H3/b11-4+