1-[2-[2-(4-methoxyphenyl)azepan-1-yl]-2-oxidanylidene-ethyl]-3-phenyl-urea

Systemtic Name: 1-[2-[2-(4-methoxyphenyl)azepan-1-yl]-2-oxidanylidene-ethyl]-3-phenyl-urea Openeye Name: 1-[2-[2-(4-methoxyphenyl)azepan-1-yl]-2-oxo-ethyl]-3-phenyl-urea CAS Name: 1-[2-[2-(4-methoxyphenyl)-1-azepanyl]-2-oxoethyl]-3-phenylurea IUPAC Name: 1-[2-[2-(4-methoxyphenyl)azepan-1-yl]-2-oxoethyl]-3-phenylurea Traditional Name: 1-[2-keto-2-[2-(4-methoxyphenyl)azepan-1-yl]ethyl]-3-phenyl-urea Formula: C22H27N3O3 MolecularWeight: 381.46808

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCCCCN2C(=O)CNC(=O)NC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)C2CCCCCN2C(=O)CNC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H27N3O3/c1-28-19-13-11-17(12-14-19)20-10-6-3-7-15-25(20)21(26)16-23-22(27)24-18-8-4-2-5-9-18/h2,4-5,8-9,11-14,20H,3,6-7,10,15-16H2,1H3,(H2,23,24,27)