4-(3-methylpiperidin-1-yl)sulfonyl-2-nitro-N-(2-pyridin-2-ylethyl)aniline

Systemtic Name: 4-(3-methylpiperidin-1-yl)sulfonyl-2-nitro-N-(2-pyridin-2-ylethyl)aniline Openeye Name: 4-[(3-methyl-1-piperidyl)sulfonyl]-2-nitro-N-[2-(2-pyridyl)ethyl]aniline CAS Name: 4-[(3-methyl-1-piperidinyl)sulfonyl]-2-nitro-N-[2-(2-pyridinyl)ethyl]aniline IUPAC Name: 4-(3-methylpiperidin-1-yl)sulfonyl-2-nitro-N-(2-pyridin-2-ylethyl)aniline Traditional Name: [4-(3-methylpiperidino)sulfonyl-2-nitro-phenyl]-[2-(2-pyridyl)ethyl]amine Formula: C19H24N4O4S MolecularWeight: 404.48326

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC(=C(C=C2)NCCC3=CC=CC=N3)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CC(=C(C=C2)NCCC3=CC=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C19H24N4O4S/c1-15-5-4-12-22(14-15)28(26,27)17-7-8-18(19(13-17)23(24)25)21-11-9-16-6-2-3-10-20-16/h2-3,6-8,10,13,15,21H,4-5,9,11-12,14H2,1H3