2-nitro-N-[(2-pyrrolidin-1-ylphenyl)methyl]-4-pyrrolidin-1-ylsulfonyl-aniline

Systemtic Name: 2-nitro-N-[(2-pyrrolidin-1-ylphenyl)methyl]-4-pyrrolidin-1-ylsulfonyl-aniline Openeye Name: 2-nitro-N-[(2-pyrrolidin-1-ylphenyl)methyl]-4-pyrrolidin-1-ylsulfonyl-aniline CAS Name: 2-nitro-N-[[2-(1-pyrrolidinyl)phenyl]methyl]-4-(1-pyrrolidinylsulfonyl)aniline IUPAC Name: 2-nitro-N-[(2-pyrrolidin-1-ylphenyl)methyl]-4-pyrrolidin-1-ylsulfonylaniline Traditional Name: (2-nitro-4-pyrrolidinosulfonyl-phenyl)-(2-pyrrolidinobenzyl)amine Formula: C21H26N4O4S MolecularWeight: 430.52054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC=CC=C2CNC3=C(C=C(C=C3)S(=O)(=O)N4CCCC4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=CC=CC=C2CNC3=C(C=C(C=C3)S(=O)(=O)N4CCCC4)[N+](=O)[O-]

InChI

InChI=1S/C21H26N4O4S/c26-25(27)21-15-18(30(28,29)24-13-5-6-14-24)9-10-19(21)22-16-17-7-1-2-8-20(17)23-11-3-4-12-23/h1-2,7-10,15,22H,3-6,11-14,16H2