1-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-3-[(1-phenylcyclopentyl)methyl]urea

Systemtic Name: 1-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-3-[(1-phenylcyclopentyl)methyl]urea Openeye Name: 1-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-3-[(1-phenylcyclopentyl)methyl]urea CAS Name: 1-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-3-[(1-phenylcyclopentyl)methyl]urea IUPAC Name: 1-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-3-[(1-phenylcyclopentyl)methyl]urea Traditional Name: 1-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-3-[(1-phenylcyclopentyl)methyl]urea Formula: C23H29N3O5 MolecularWeight: 427.49346

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CCNC(=O)NCC2(CCCC2)C3=CC=CC=C3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CCNC(=O)NCC2(CCCC2)C3=CC=CC=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C23H29N3O5/c1-30-20-14-17(19(26(28)29)15-21(20)31-2)10-13-24-22(27)25-16-23(11-6-7-12-23)18-8-4-3-5-9-18/h3-5,8-9,14-15H,6-7,10-13,16H2,1-2H3,(H2,24,25,27)