4-(4-ethylphenyl)-2,2,4-trimethyl-1-[(4-nitrophenyl)methyl]-3H-quinoline

Systemtic Name: 4-(4-ethylphenyl)-2,2,4-trimethyl-1-[(4-nitrophenyl)methyl]-3H-quinoline Openeye Name: 4-(4-ethylphenyl)-2,2,4-trimethyl-1-[(4-nitrophenyl)methyl]-3H-quinoline CAS Name: 4-(4-ethylphenyl)-2,2,4-trimethyl-1-[(4-nitrophenyl)methyl]-3H-quinoline IUPAC Name: 4-(4-ethylphenyl)-2,2,4-trimethyl-1-[(4-nitrophenyl)methyl]-3H-quinoline Traditional Name: 4-(4-ethylphenyl)-2,2,4-trimethyl-1-(4-nitrobenzyl)-3H-quinoline Formula: C27H30N2O2 MolecularWeight: 414.5393

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2(CC(N(C3=CC=CC=C32)CC4=CC=C(C=C4)[N+](=O)[O-])(C)C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C2(CC(N(C3=CC=CC=C32)CC4=CC=C(C=C4)[N+](=O)[O-])(C)C)C

InChI

InChI=1S/C27H30N2O2/c1-5-20-10-14-22(15-11-20)27(4)19-26(2,3)28(25-9-7-6-8-24(25)27)18-21-12-16-23(17-13-21)29(30)31/h6-17H,5,18-19H2,1-4H3