1-[2-(3,4-diethoxyphenyl)ethyl]-3-[(5-methyl-1,2-benzoxazol-3-yl)methyl]urea

Systemtic Name: 1-[2-(3,4-diethoxyphenyl)ethyl]-3-[(5-methyl-1,2-benzoxazol-3-yl)methyl]urea Openeye Name: 1-[2-(3,4-diethoxyphenyl)ethyl]-3-[(5-methyl-1,2-benzoxazol-3-yl)methyl]urea CAS Name: 1-[2-(3,4-diethoxyphenyl)ethyl]-3-[(5-methyl-1,2-benzoxazol-3-yl)methyl]urea IUPAC Name: 1-[2-(3,4-diethoxyphenyl)ethyl]-3-[(5-methyl-1,2-benzoxazol-3-yl)methyl]urea Traditional Name: 1-[2-(3,4-diethoxyphenyl)ethyl]-3-[(5-methylindoxazen-3-yl)methyl]urea Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCNC(=O)NCC2=NOC3=C2C=C(C=C3)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCNC(=O)NCC2=NOC3=C2C=C(C=C3)C)OCC

InChI

InChI=1S/C22H27N3O4/c1-4-27-20-9-7-16(13-21(20)28-5-2)10-11-23-22(26)24-14-18-17-12-15(3)6-8-19(17)29-25-18/h6-9,12-13H,4-5,10-11,14H2,1-3H3,(H2,23,24,26)