N-[(1R)-1-cyclopropylethyl]-N-methyl-4-(4-methylpiperidin-1-yl)sulfonyl-2-nitro-aniline

Systemtic Name: N-[(1R)-1-cyclopropylethyl]-N-methyl-4-(4-methylpiperidin-1-yl)sulfonyl-2-nitro-aniline Openeye Name: N-[(1R)-1-cyclopropylethyl]-N-methyl-4-[(4-methyl-1-piperidyl)sulfonyl]-2-nitro-aniline CAS Name: N-[(1R)-1-cyclopropylethyl]-N-methyl-4-[(4-methyl-1-piperidinyl)sulfonyl]-2-nitroaniline IUPAC Name: N-[(1R)-1-cyclopropylethyl]-N-methyl-4-(4-methylpiperidin-1-yl)sulfonyl-2-nitroaniline Traditional Name: [(1R)-1-cyclopropylethyl]-methyl-[4-(4-methylpiperidino)sulfonyl-2-nitro-phenyl]amine Formula: C18H27N3O4S MolecularWeight: 381.48968

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N(C)C(C)C3CC3)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N(C)[C@H](C)C3CC3)[N+](=O)[O-]

InChI

InChI=1S/C18H27N3O4S/c1-13-8-10-20(11-9-13)26(24,25)16-6-7-17(18(12-16)21(22)23)19(3)14(2)15-4-5-15/h6-7,12-15H,4-5,8-11H2,1-3H3/t14-/m1/s1