2-[(2-chloranyl-5-nitro-phenyl)methyl-methyl-amino]-N-(4-pyrrolidin-1-ylphenyl)ethanamide

Systemtic Name: 2-[(2-chloranyl-5-nitro-phenyl)methyl-methyl-amino]-N-(4-pyrrolidin-1-ylphenyl)ethanamide Openeye Name: 2-[(2-chloro-5-nitro-phenyl)methyl-methyl-amino]-N-(4-pyrrolidin-1-ylphenyl)acetamide CAS Name: 2-[(2-chloro-5-nitrophenyl)methyl-methylamino]-N-[4-(1-pyrrolidinyl)phenyl]acetamide IUPAC Name: 2-[(2-chloro-5-nitrophenyl)methyl-methylamino]-N-(4-pyrrolidin-1-ylphenyl)acetamide Traditional Name: 2-[(2-chloro-5-nitro-benzyl)-methyl-amino]-N-(4-pyrrolidinophenyl)acetamide Formula: C20H23ClN4O3 MolecularWeight: 402.87462

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC(=C1)[N+](=O)[O-])Cl)CC(=O)NC2=CC=C(C=C2)N3CCCC3

Isomeric SMILES

CN(CC1=C(C=CC(=C1)[N+](=O)[O-])Cl)CC(=O)NC2=CC=C(C=C2)N3CCCC3

InChI

InChI=1S/C20H23ClN4O3/c1-23(13-15-12-18(25(27)28)8-9-19(15)21)14-20(26)22-16-4-6-17(7-5-16)24-10-2-3-11-24/h4-9,12H,2-3,10-11,13-14H2,1H3,(H,22,26)