4-(3-methylpiperidin-1-yl)sulfonyl-2-nitro-N-(oxolan-2-ylmethyl)aniline

Systemtic Name: 4-(3-methylpiperidin-1-yl)sulfonyl-2-nitro-N-(oxolan-2-ylmethyl)aniline Openeye Name: 4-[(3-methyl-1-piperidyl)sulfonyl]-2-nitro-N-(tetrahydrofuran-2-ylmethyl)aniline CAS Name: 4-[(3-methyl-1-piperidinyl)sulfonyl]-2-nitro-N-(2-oxolanylmethyl)aniline IUPAC Name: 4-(3-methylpiperidin-1-yl)sulfonyl-2-nitro-N-(oxolan-2-ylmethyl)aniline Traditional Name: [4-(3-methylpiperidino)sulfonyl-2-nitro-phenyl]-(tetrahydrofurfuryl)amine Formula: C17H25N3O5S MolecularWeight: 383.4625

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC(=C(C=C2)NCC3CCCO3)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CC(=C(C=C2)NCC3CCCO3)[N+](=O)[O-]

InChI

InChI=1S/C17H25N3O5S/c1-13-4-2-8-19(12-13)26(23,24)15-6-7-16(17(10-15)20(21)22)18-11-14-5-3-9-25-14/h6-7,10,13-14,18H,2-5,8-9,11-12H2,1H3