3-[(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-propyl]-1-methyl-1-(phenylmethyl)urea

Systemtic Name: 3-[(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-propyl]-1-methyl-1-(phenylmethyl)urea Openeye Name: 1-benzyl-3-[(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-propyl]-1-methyl-urea CAS Name: 3-[(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methylpropyl]-1-methyl-1-(phenylmethyl)urea IUPAC Name: 1-benzyl-3-[(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methylpropyl]-1-methylurea Traditional Name: 1-benzyl-3-[(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-propyl]-1-methyl-urea Formula: C22H28N2O3 MolecularWeight: 368.46932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC2=C(C=C1)OCCCO2)NC(=O)N(C)CC3=CC=CC=C3

Isomeric SMILES

CC(C)[C@@H](C1=CC2=C(C=C1)OCCCO2)NC(=O)N(C)CC3=CC=CC=C3

InChI

InChI=1S/C22H28N2O3/c1-16(2)21(18-10-11-19-20(14-18)27-13-7-12-26-19)23-22(25)24(3)15-17-8-5-4-6-9-17/h4-6,8-11,14,16,21H,7,12-13,15H2,1-3H3,(H,23,25)/t21-/m0/s1