N,N-bis(2-methoxyethyl)-4-(3-methylpiperidin-1-yl)sulfonyl-2-nitro-aniline

Systemtic Name: N,N-bis(2-methoxyethyl)-4-(3-methylpiperidin-1-yl)sulfonyl-2-nitro-aniline Openeye Name: N,N-bis(2-methoxyethyl)-4-[(3-methyl-1-piperidyl)sulfonyl]-2-nitro-aniline CAS Name: N,N-bis(2-methoxyethyl)-4-[(3-methyl-1-piperidinyl)sulfonyl]-2-nitroaniline IUPAC Name: N,N-bis(2-methoxyethyl)-4-(3-methylpiperidin-1-yl)sulfonyl-2-nitroaniline Traditional Name: bis(2-methoxyethyl)-[4-(3-methylpiperidino)sulfonyl-2-nitro-phenyl]amine Formula: C18H29N3O6S MolecularWeight: 415.50436

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H29N3O6S/c1-15-5-4-8-20(14-15)28(24,25)16-6-7-17(18(13-16)21(22)23)19(9-11-26-2)10-12-27-3/h6-7,13,15H,4-5,8-12,14H2,1-3H3