1-[(1-methylpyrrol-2-yl)methyl]-1-(3-morpholin-4-ylpropyl)-3-(4-nitrophenyl)urea

Systemtic Name: 1-[(1-methylpyrrol-2-yl)methyl]-1-(3-morpholin-4-ylpropyl)-3-(4-nitrophenyl)urea Openeye Name: 1-[(1-methylpyrrol-2-yl)methyl]-1-(3-morpholinopropyl)-3-(4-nitrophenyl)urea CAS Name: 1-[(1-methyl-2-pyrrolyl)methyl]-1-[3-(4-morpholinyl)propyl]-3-(4-nitrophenyl)urea IUPAC Name: 1-[(1-methylpyrrol-2-yl)methyl]-1-(3-morpholin-4-ylpropyl)-3-(4-nitrophenyl)urea Traditional Name: 1-[(1-methylpyrrol-2-yl)methyl]-1-(3-morpholinopropyl)-3-(4-nitrophenyl)urea Formula: C20H27N5O4 MolecularWeight: 401.45948

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1CN(CCCN2CCOCC2)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CN1C=CC=C1CN(CCCN2CCOCC2)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H27N5O4/c1-22-9-2-4-19(22)16-24(11-3-10-23-12-14-29-15-13-23)20(26)21-17-5-7-18(8-6-17)25(27)28/h2,4-9H,3,10-16H2,1H3,(H,21,26)