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

Systemtic Name: N-(cyclopropylmethyl)-4-(3-methylpiperidin-1-yl)sulfonyl-2-nitro-aniline Openeye Name: N-(cyclopropylmethyl)-4-[(3-methyl-1-piperidyl)sulfonyl]-2-nitro-aniline CAS Name: N-(cyclopropylmethyl)-4-[(3-methyl-1-piperidinyl)sulfonyl]-2-nitroaniline IUPAC Name: N-(cyclopropylmethyl)-4-(3-methylpiperidin-1-yl)sulfonyl-2-nitroaniline Traditional Name: cyclopropylmethyl-[4-(3-methylpiperidino)sulfonyl-2-nitro-phenyl]amine Formula: C16H23N3O4S MolecularWeight: 353.43652

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC(=C(C=C2)NCC3CC3)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CC(=C(C=C2)NCC3CC3)[N+](=O)[O-]

InChI

InChI=1S/C16H23N3O4S/c1-12-3-2-8-18(11-12)24(22,23)14-6-7-15(16(9-14)19(20)21)17-10-13-4-5-13/h6-7,9,12-13,17H,2-5,8,10-11H2,1H3