1-cyclohexyl-1-[[1-[(3-methoxyphenyl)methyl]pyrrol-2-yl]methyl]-3-(4-nitrophenyl)urea

Systemtic Name: 1-cyclohexyl-1-[[1-[(3-methoxyphenyl)methyl]pyrrol-2-yl]methyl]-3-(4-nitrophenyl)urea Openeye Name: 1-cyclohexyl-1-[[1-[(3-methoxyphenyl)methyl]pyrrol-2-yl]methyl]-3-(4-nitrophenyl)urea CAS Name: 1-cyclohexyl-1-[[1-[(3-methoxyphenyl)methyl]-2-pyrrolyl]methyl]-3-(4-nitrophenyl)urea IUPAC Name: 1-cyclohexyl-1-[[1-[(3-methoxyphenyl)methyl]pyrrol-2-yl]methyl]-3-(4-nitrophenyl)urea Traditional Name: 1-cyclohexyl-1-[(1-m-anisylpyrrol-2-yl)methyl]-3-(4-nitrophenyl)urea Formula: C26H30N4O4 MolecularWeight: 462.5408

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN2C=CC=C2CN(C3CCCCC3)C(=O)NC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)CN2C=CC=C2CN(C3CCCCC3)C(=O)NC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C26H30N4O4/c1-34-25-11-5-7-20(17-25)18-28-16-6-10-24(28)19-29(22-8-3-2-4-9-22)26(31)27-21-12-14-23(15-13-21)30(32)33/h5-7,10-17,22H,2-4,8-9,18-19H2,1H3,(H,27,31)