2-chloranyl-N-[4-(dioctylamino)phenyl]-5-nitro-N-phenyl-benzamide

Systemtic Name: 2-chloranyl-N-[4-(dioctylamino)phenyl]-5-nitro-N-phenyl-benzamide Openeye Name: 2-chloro-N-[4-(dioctylamino)phenyl]-5-nitro-N-phenyl-benzamide CAS Name: 2-chloro-N-[4-(dioctylamino)phenyl]-5-nitro-N-phenylbenzamide IUPAC Name: 2-chloro-N-[4-(dioctylamino)phenyl]-5-nitro-N-phenylbenzamide Traditional Name: 2-chloro-N-[4-(dioctylamino)phenyl]-5-nitro-N-phenyl-benzamide Formula: C35H46ClN3O3 MolecularWeight: 592.21104

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN(CCCCCCCC)C1=CC=C(C=C1)N(C2=CC=CC=C2)C(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CCCCCCCCN(CCCCCCCC)C1=CC=C(C=C1)N(C2=CC=CC=C2)C(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C35H46ClN3O3/c1-3-5-7-9-11-16-26-37(27-17-12-10-8-6-4-2)29-20-22-31(23-21-29)38(30-18-14-13-15-19-30)35(40)33-28-32(39(41)42)24-25-34(33)36/h13-15,18-25,28H,3-12,16-17,26-27H2,1-2H3