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

Systemtic Name: N-[(1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-propyl]-3-pyrrol-1-yl-benzamide Openeye Name: N-[(1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-propyl]-3-pyrrol-1-yl-benzamide CAS Name: N-[(1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methylpropyl]-3-(1-pyrrolyl)benzamide IUPAC Name: N-[(1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methylpropyl]-3-pyrrol-1-ylbenzamide Traditional Name: N-[(1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-propyl]-3-pyrrol-1-yl-benzamide Formula: C24H26N2O3 MolecularWeight: 390.47484

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC2=C(C=C1)OCCCO2)NC(=O)C3=CC(=CC=C3)N4C=CC=C4

Isomeric SMILES

CC(C)[C@H](C1=CC2=C(C=C1)OCCCO2)NC(=O)C3=CC(=CC=C3)N4C=CC=C4

InChI

InChI=1S/C24H26N2O3/c1-17(2)23(18-9-10-21-22(16-18)29-14-6-13-28-21)25-24(27)19-7-5-8-20(15-19)26-11-3-4-12-26/h3-5,7-12,15-17,23H,6,13-14H2,1-2H3,(H,25,27)/t23-/m1/s1