N-[3-[3-[1-(6-methyl-3-nitro-pyridin-2-yl)piperidin-4-ylidene]prop-1-ynyl]phenyl]ethanamide

Systemtic Name: N-[3-[3-[1-(6-methyl-3-nitro-pyridin-2-yl)piperidin-4-ylidene]prop-1-ynyl]phenyl]ethanamide Openeye Name: N-[3-[3-[1-(6-methyl-3-nitro-2-pyridyl)-4-piperidylidene]prop-1-ynyl]phenyl]acetamide CAS Name: N-[3-[3-[1-(6-methyl-3-nitro-2-pyridinyl)-4-piperidinylidene]prop-1-ynyl]phenyl]acetamide IUPAC Name: N-[3-[3-[1-(6-methyl-3-nitropyridin-2-yl)piperidin-4-ylidene]prop-1-ynyl]phenyl]acetamide Traditional Name: N-[3-[3-[1-(6-methyl-3-nitro-2-pyridyl)-4-piperidylidene]prop-1-ynyl]phenyl]acetamide Formula: C22H22N4O3 MolecularWeight: 390.43508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)[N+](=O)[O-])N2CCC(=CC#CC3=CC(=CC=C3)NC(=O)C)CC2

Isomeric SMILES

CC1=NC(=C(C=C1)[N+](=O)[O-])N2CCC(=CC#CC3=CC(=CC=C3)NC(=O)C)CC2

InChI

InChI=1S/C22H22N4O3/c1-16-9-10-21(26(28)29)22(23-16)25-13-11-18(12-14-25)5-3-6-19-7-4-8-20(15-19)24-17(2)27/h4-5,7-10,15H,11-14H2,1-2H3,(H,24,27)