N4-(7-chloranylquinolin-4-yl)-N1-[[1-(4-nitrophenyl)pyrrolidin-2-yl]methyl]cyclohexane-1,4-diamine

Systemtic Name: N4-(7-chloranylquinolin-4-yl)-N1-[[1-(4-nitrophenyl)pyrrolidin-2-yl]methyl]cyclohexane-1,4-diamine Openeye Name: N4-(7-chloro-4-quinolyl)-N1-[[1-(4-nitrophenyl)pyrrolidin-2-yl]methyl]cyclohexane-1,4-diamine CAS Name: N4-(7-chloro-4-quinolinyl)-N1-[[1-(4-nitrophenyl)-2-pyrrolidinyl]methyl]cyclohexane-1,4-diamine IUPAC Name: 4-N-(7-chloroquinolin-4-yl)-1-N-[[1-(4-nitrophenyl)pyrrolidin-2-yl]methyl]cyclohexane-1,4-diamine Traditional Name: (7-chloro-4-quinolyl)-[4-[[1-(4-nitrophenyl)pyrrolidin-2-yl]methylamino]cyclohexyl]amine Formula: C26H30ClN5O2 MolecularWeight: 480.0017

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C2=CC=C(C=C2)[N+](=O)[O-])CNC3CCC(CC3)NC4=C5C=CC(=CC5=NC=C4)Cl

Isomeric SMILES

C1CC(N(C1)C2=CC=C(C=C2)[N+](=O)[O-])CNC3CCC(CC3)NC4=C5C=CC(=CC5=NC=C4)Cl

InChI

InChI=1S/C26H30ClN5O2/c27-18-3-12-24-25(13-14-28-26(24)16-18)30-20-6-4-19(5-7-20)29-17-23-2-1-15-31(23)21-8-10-22(11-9-21)32(33)34/h3,8-14,16,19-20,23,29H,1-2,4-7,15,17H2,(H,28,30)