1-(2-methyl-3-nitro-phenyl)-3-[4-[6-(morpholin-4-ylmethyl)pyridin-3-yl]naphthalen-1-yl]urea

Systemtic Name: 1-(2-methyl-3-nitro-phenyl)-3-[4-[6-(morpholin-4-ylmethyl)pyridin-3-yl]naphthalen-1-yl]urea Openeye Name: 1-(2-methyl-3-nitro-phenyl)-3-[4-[6-(morpholinomethyl)-3-pyridyl]-1-naphthyl]urea CAS Name: 1-(2-methyl-3-nitrophenyl)-3-[4-[6-(4-morpholinylmethyl)-3-pyridinyl]-1-naphthalenyl]urea IUPAC Name: 1-(2-methyl-3-nitrophenyl)-3-[4-[6-(morpholin-4-ylmethyl)pyridin-3-yl]naphthalen-1-yl]urea Traditional Name: 1-(2-methyl-3-nitro-phenyl)-3-[4-[6-(morpholinomethyl)-3-pyridyl]-1-naphthyl]urea Formula: C28H27N5O4 MolecularWeight: 497.54508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)NC2=CC=C(C3=CC=CC=C32)C4=CN=C(C=C4)CN5CCOCC5

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)NC2=CC=C(C3=CC=CC=C32)C4=CN=C(C=C4)CN5CCOCC5

InChI

InChI=1S/C28H27N5O4/c1-19-25(7-4-8-27(19)33(35)36)30-28(34)31-26-12-11-22(23-5-2-3-6-24(23)26)20-9-10-21(29-17-20)18-32-13-15-37-16-14-32/h2-12,17H,13-16,18H2,1H3,(H2,30,31,34)