N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-[(propan-2-ylcarbamoylamino)methyl]benzamide

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-[(propan-2-ylcarbamoylamino)methyl]benzamide Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-[(isopropylcarbamoylamino)methyl]benzamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-[[[oxo-(propan-2-ylamino)methyl]amino]methyl]benzamide IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-[(propan-2-ylcarbamoylamino)methyl]benzamide Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-[(isopropylcarbamoylamino)methyl]benzamide Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C21H25N3O4/c1-14(2)23-21(26)22-13-15-4-6-16(7-5-15)20(25)24-17-8-9-18-19(12-17)28-11-3-10-27-18/h4-9,12,14H,3,10-11,13H2,1-2H3,(H,24,25)(H2,22,23,26)