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

Systemtic Name: 1-(4-ethoxyphenyl)-3-(2-methoxyphenyl)-1-(3,4,5,6-tetrahydro-2H-azepin-7-yl)urea Openeye Name: 1-(4-ethoxyphenyl)-3-(2-methoxyphenyl)-1-(3,4,5,6-tetrahydro-2H-azepin-7-yl)urea CAS Name: 1-(4-ethoxyphenyl)-3-(2-methoxyphenyl)-1-(3,4,5,6-tetrahydro-2H-azepin-7-yl)urea IUPAC Name: 1-(4-ethoxyphenyl)-3-(2-methoxyphenyl)-1-(3,4,5,6-tetrahydro-2H-azepin-7-yl)urea Traditional Name: 3-(2-methoxyphenyl)-1-p-phenetyl-1-(3,4,5,6-tetrahydro-2H-azepin-7-yl)urea Formula: C22H27N3O3 MolecularWeight: 381.46808

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N(C2=NCCCCC2)C(=O)NC3=CC=CC=C3OC

Isomeric SMILES

CCOC1=CC=C(C=C1)N(C2=NCCCCC2)C(=O)NC3=CC=CC=C3OC

InChI

InChI=1S/C22H27N3O3/c1-3-28-18-14-12-17(13-15-18)25(21-11-5-4-8-16-23-21)22(26)24-19-9-6-7-10-20(19)27-2/h6-7,9-10,12-15H,3-5,8,11,16H2,1-2H3,(H,24,26)