ethyl 2,5-dimethyl-1-(naphthalen-1-ylmethyl)-4-(4-nitrophenyl)pyrrole-3-carboxylate

Systemtic Name: ethyl 2,5-dimethyl-1-(naphthalen-1-ylmethyl)-4-(4-nitrophenyl)pyrrole-3-carboxylate Openeye Name: ethyl 2,5-dimethyl-1-(1-naphthylmethyl)-4-(4-nitrophenyl)pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-1-(1-naphthalenylmethyl)-4-(4-nitrophenyl)-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 2,5-dimethyl-1-(naphthalen-1-ylmethyl)-4-(4-nitrophenyl)pyrrole-3-carboxylate Traditional Name: 2,5-dimethyl-1-(1-naphthylmethyl)-4-(4-nitrophenyl)pyrrole-3-carboxylic acid ethyl ester Formula: C26H24N2O4 MolecularWeight: 428.47976

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1C2=CC=C(C=C2)[N+](=O)[O-])C)CC3=CC=CC4=CC=CC=C43)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1C2=CC=C(C=C2)[N+](=O)[O-])C)CC3=CC=CC4=CC=CC=C43)C

InChI

InChI=1S/C26H24N2O4/c1-4-32-26(29)25-18(3)27(16-21-10-7-9-19-8-5-6-11-23(19)21)17(2)24(25)20-12-14-22(15-13-20)28(30)31/h5-15H,4,16H2,1-3H3