N-[2-(4-hydroxyphenyl)ethyl]-2,5-dimethyl-4-(4-nitrophenyl)-1-(phenylmethyl)pyrrole-3-carboxamide

Systemtic Name: N-[2-(4-hydroxyphenyl)ethyl]-2,5-dimethyl-4-(4-nitrophenyl)-1-(phenylmethyl)pyrrole-3-carboxamide Openeye Name: 1-benzyl-N-[2-(4-hydroxyphenyl)ethyl]-2,5-dimethyl-4-(4-nitrophenyl)pyrrole-3-carboxamide CAS Name: N-[2-(4-hydroxyphenyl)ethyl]-2,5-dimethyl-4-(4-nitrophenyl)-1-(phenylmethyl)-3-pyrrolecarboxamide IUPAC Name: 1-benzyl-N-[2-(4-hydroxyphenyl)ethyl]-2,5-dimethyl-4-(4-nitrophenyl)pyrrole-3-carboxamide Traditional Name: 1-benzyl-N-[2-(4-hydroxyphenyl)ethyl]-2,5-dimethyl-4-(4-nitrophenyl)pyrrole-3-carboxamide Formula: C28H27N3O4 MolecularWeight: 469.53168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1CC2=CC=CC=C2)C)C(=O)NCCC3=CC=C(C=C3)O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=C(N1CC2=CC=CC=C2)C)C(=O)NCCC3=CC=C(C=C3)O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C28H27N3O4/c1-19-26(23-10-12-24(13-11-23)31(34)35)27(20(2)30(19)18-22-6-4-3-5-7-22)28(33)29-17-16-21-8-14-25(32)15-9-21/h3-15,32H,16-18H2,1-2H3,(H,29,33)