1-(4-methoxyphenyl)-3-phenyl-1-(3,4,5,6-tetrahydro-2H-azepin-7-yl)urea

Systemtic Name: 1-(4-methoxyphenyl)-3-phenyl-1-(3,4,5,6-tetrahydro-2H-azepin-7-yl)urea Openeye Name: 1-(4-methoxyphenyl)-3-phenyl-1-(3,4,5,6-tetrahydro-2H-azepin-7-yl)urea CAS Name: 1-(4-methoxyphenyl)-3-phenyl-1-(3,4,5,6-tetrahydro-2H-azepin-7-yl)urea IUPAC Name: 1-(4-methoxyphenyl)-3-phenyl-1-(3,4,5,6-tetrahydro-2H-azepin-7-yl)urea Traditional Name: 1-(4-methoxyphenyl)-3-phenyl-1-(3,4,5,6-tetrahydro-2H-azepin-7-yl)urea Formula: C20H23N3O2 MolecularWeight: 337.41552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N(C2=NCCCCC2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)N(C2=NCCCCC2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C20H23N3O2/c1-25-18-13-11-17(12-14-18)23(19-10-6-3-7-15-21-19)20(24)22-16-8-4-2-5-9-16/h2,4-5,8-9,11-14H,3,6-7,10,15H2,1H3,(H,22,24)