N-[(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-propyl]-3,5-dimethyl-benzamide

Systemtic Name: N-[(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-propyl]-3,5-dimethyl-benzamide Openeye Name: N-[(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-propyl]-3,5-dimethyl-benzamide CAS Name: N-[(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methylpropyl]-3,5-dimethylbenzamide IUPAC Name: N-[(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methylpropyl]-3,5-dimethylbenzamide Traditional Name: N-[(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-propyl]-3,5-dimethyl-benzamide Formula: C22H27NO3 MolecularWeight: 353.45468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)NC(C2=CC3=C(C=C2)OCCCO3)C(C)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)N[C@H](C2=CC3=C(C=C2)OCCCO3)C(C)C)C

InChI

InChI=1S/C22H27NO3/c1-14(2)21(23-22(24)18-11-15(3)10-16(4)12-18)17-6-7-19-20(13-17)26-9-5-8-25-19/h6-7,10-14,21H,5,8-9H2,1-4H3,(H,23,24)/t21-/m0/s1