N-[(1R)-1-(furan-2-yl)ethyl]-4-(4-methylpiperidin-1-yl)sulfonyl-2-nitro-aniline

Systemtic Name: N-[(1R)-1-(furan-2-yl)ethyl]-4-(4-methylpiperidin-1-yl)sulfonyl-2-nitro-aniline Openeye Name: N-[(1R)-1-(2-furyl)ethyl]-4-[(4-methyl-1-piperidyl)sulfonyl]-2-nitro-aniline CAS Name: N-[(1R)-1-(2-furanyl)ethyl]-4-[(4-methyl-1-piperidinyl)sulfonyl]-2-nitroaniline IUPAC Name: N-[(1R)-1-(furan-2-yl)ethyl]-4-(4-methylpiperidin-1-yl)sulfonyl-2-nitroaniline Traditional Name: [(1R)-1-(2-furyl)ethyl]-[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)NC(C)C3=CC=CO3)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N[C@H](C)C3=CC=CO3)[N+](=O)[O-]

InChI

InChI=1S/C18H23N3O5S/c1-13-7-9-20(10-8-13)27(24,25)15-5-6-16(17(12-15)21(22)23)19-14(2)18-4-3-11-26-18/h3-6,11-14,19H,7-10H2,1-2H3/t14-/m1/s1