N-(furan-2-ylmethyl)-N-methyl-4-(4-methylpiperidin-1-yl)sulfonyl-2-nitro-aniline

Systemtic Name: N-(furan-2-ylmethyl)-N-methyl-4-(4-methylpiperidin-1-yl)sulfonyl-2-nitro-aniline Openeye Name: N-(2-furylmethyl)-N-methyl-4-[(4-methyl-1-piperidyl)sulfonyl]-2-nitro-aniline CAS Name: N-(2-furanylmethyl)-N-methyl-4-[(4-methyl-1-piperidinyl)sulfonyl]-2-nitroaniline IUPAC Name: N-(furan-2-ylmethyl)-N-methyl-4-(4-methylpiperidin-1-yl)sulfonyl-2-nitroaniline Traditional Name: 2-furfuryl-methyl-[4-(4-methylpiperidino)sulfonyl-2-nitro-phenyl]amine Formula: C18H23N3O5S MolecularWeight: 393.45732

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N(C)CC3=CC=CO3)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N(C)CC3=CC=CO3)[N+](=O)[O-]

InChI

InChI=1S/C18H23N3O5S/c1-14-7-9-20(10-8-14)27(24,25)16-5-6-17(18(12-16)21(22)23)19(2)13-15-4-3-11-26-15/h3-6,11-12,14H,7-10,13H2,1-2H3