N-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]-4-nitro-2-pyrrolidin-1-ylsulfonyl-aniline

Systemtic Name: N-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]-4-nitro-2-pyrrolidin-1-ylsulfonyl-aniline Openeye Name: N-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]-4-nitro-2-pyrrolidin-1-ylsulfonyl-aniline CAS Name: N-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]-4-nitro-2-(1-pyrrolidinylsulfonyl)aniline IUPAC Name: N-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]-4-nitro-2-pyrrolidin-1-ylsulfonylaniline Traditional Name: 2-(3,4-dihydro-2H-quinolin-1-yl)ethyl-(4-nitro-2-pyrrolidinosulfonyl-phenyl)amine Formula: C21H26N4O4S MolecularWeight: 430.52054

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NCCN3CCCC4=CC=CC=C43

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NCCN3CCCC4=CC=CC=C43

InChI

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