N-methyl-2-nitro-N-(phenylmethyl)-4-pyrrolidin-1-ylsulfonyl-aniline

Systemtic Name: N-methyl-2-nitro-N-(phenylmethyl)-4-pyrrolidin-1-ylsulfonyl-aniline Openeye Name: N-benzyl-N-methyl-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline CAS Name: N-methyl-2-nitro-N-(phenylmethyl)-4-(1-pyrrolidinylsulfonyl)aniline IUPAC Name: N-benzyl-N-methyl-2-nitro-4-pyrrolidin-1-ylsulfonylaniline Traditional Name: benzyl-methyl-(2-nitro-4-pyrrolidinosulfonyl-phenyl)amine Formula: C18H21N3O4S MolecularWeight: 375.44204

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC=CC=C1)C2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C18H21N3O4S/c1-19(14-15-7-3-2-4-8-15)17-10-9-16(13-18(17)21(22)23)26(24,25)20-11-5-6-12-20/h2-4,7-10,13H,5-6,11-12,14H2,1H3