4-[[1-(2-methylfuran-3-yl)carbonylpiperidin-4-yl]amino]-3-nitro-benzenecarbonitrile

Systemtic Name: 4-[[1-(2-methylfuran-3-yl)carbonylpiperidin-4-yl]amino]-3-nitro-benzenecarbonitrile Openeye Name: 4-[[1-(2-methylfuran-3-carbonyl)-4-piperidyl]amino]-3-nitro-benzonitrile CAS Name: 4-[[1-[(2-methyl-3-furanyl)-oxomethyl]-4-piperidinyl]amino]-3-nitrobenzonitrile IUPAC Name: 4-[[1-(2-methylfuran-3-carbonyl)piperidin-4-yl]amino]-3-nitrobenzonitrile Traditional Name: 4-[[1-(2-methyl-3-furoyl)-4-piperidyl]amino]-3-nitro-benzonitrile Formula: C18H18N4O4 MolecularWeight: 354.35992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C(=O)N2CCC(CC2)NC3=C(C=C(C=C3)C#N)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CO1)C(=O)N2CCC(CC2)NC3=C(C=C(C=C3)C#N)[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O4/c1-12-15(6-9-26-12)18(23)21-7-4-14(5-8-21)20-16-3-2-13(11-19)10-17(16)22(24)25/h2-3,6,9-10,14,20H,4-5,7-8H2,1H3