N-butyl-2,5-dimethyl-4-(4-nitrophenyl)-1-(phenylmethyl)pyrrole-3-carboxamide

Systemtic Name: N-butyl-2,5-dimethyl-4-(4-nitrophenyl)-1-(phenylmethyl)pyrrole-3-carboxamide Openeye Name: 1-benzyl-N-butyl-2,5-dimethyl-4-(4-nitrophenyl)pyrrole-3-carboxamide CAS Name: N-butyl-2,5-dimethyl-4-(4-nitrophenyl)-1-(phenylmethyl)-3-pyrrolecarboxamide IUPAC Name: 1-benzyl-N-butyl-2,5-dimethyl-4-(4-nitrophenyl)pyrrole-3-carboxamide Traditional Name: 1-benzyl-N-butyl-2,5-dimethyl-4-(4-nitrophenyl)pyrrole-3-carboxamide Formula: C24H27N3O3 MolecularWeight: 405.48948

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=C(N(C(=C1C2=CC=C(C=C2)[N+](=O)[O-])C)CC3=CC=CC=C3)C

Isomeric SMILES

CCCCNC(=O)C1=C(N(C(=C1C2=CC=C(C=C2)[N+](=O)[O-])C)CC3=CC=CC=C3)C

InChI

InChI=1S/C24H27N3O3/c1-4-5-15-25-24(28)23-18(3)26(16-19-9-7-6-8-10-19)17(2)22(23)20-11-13-21(14-12-20)27(29)30/h6-14H,4-5,15-16H2,1-3H3,(H,25,28)