1-[2-(diethylamino)-3-phenyl-propyl]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)urea

Systemtic Name: 1-[2-(diethylamino)-3-phenyl-propyl]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)urea Openeye Name: 1-[2-(diethylamino)-3-phenyl-propyl]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)urea CAS Name: 1-[2-(diethylamino)-3-phenylpropyl]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)urea IUPAC Name: 1-[2-(diethylamino)-3-phenylpropyl]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)urea Traditional Name: 1-[2-(diethylamino)-3-phenyl-propyl]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)urea Formula: C23H31N3O3 MolecularWeight: 397.51054

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(CC1=CC=CC=C1)CNC(=O)NC2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CCN(CC)C(CC1=CC=CC=C1)CNC(=O)NC2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C23H31N3O3/c1-3-26(4-2)20(15-18-9-6-5-7-10-18)17-24-23(27)25-19-11-12-21-22(16-19)29-14-8-13-28-21/h5-7,9-12,16,20H,3-4,8,13-15,17H2,1-2H3,(H2,24,25,27)