1-butyl-3-(4-nitrophenyl)-1-[[1-(phenylmethyl)pyrrol-2-yl]methyl]urea

Systemtic Name: 1-butyl-3-(4-nitrophenyl)-1-[[1-(phenylmethyl)pyrrol-2-yl]methyl]urea Openeye Name: 1-[(1-benzylpyrrol-2-yl)methyl]-1-butyl-3-(4-nitrophenyl)urea CAS Name: 1-butyl-3-(4-nitrophenyl)-1-[[1-(phenylmethyl)-2-pyrrolyl]methyl]urea IUPAC Name: 1-[(1-benzylpyrrol-2-yl)methyl]-1-butyl-3-(4-nitrophenyl)urea Traditional Name: 1-[(1-benzylpyrrol-2-yl)methyl]-1-butyl-3-(4-nitrophenyl)urea Formula: C23H26N4O3 MolecularWeight: 406.47754

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CN1CC2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCN(CC1=CC=CN1CC2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H26N4O3/c1-2-3-15-26(23(28)24-20-11-13-21(14-12-20)27(29)30)18-22-10-7-16-25(22)17-19-8-5-4-6-9-19/h4-14,16H,2-3,15,17-18H2,1H3,(H,24,28)