[(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-(4-pyrrol-1-ylphenyl)methanone

Systemtic Name: [(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-(4-pyrrol-1-ylphenyl)methanone Openeye Name: [(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-(4-pyrrol-1-ylphenyl)methanone CAS Name: [(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-pyrrolidinyl]-[4-(1-pyrrolyl)phenyl]methanone IUPAC Name: [(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-(4-pyrrol-1-ylphenyl)methanone Traditional Name: [(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidino]-(4-pyrrol-1-ylphenyl)methanone Formula: C24H24N2O3 MolecularWeight: 388.45896

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2=CC=C(C=C2)N3C=CC=C3)C4=CC5=C(C=C4)OCCCO5

Isomeric SMILES

C1C[C@@H](N(C1)C(=O)C2=CC=C(C=C2)N3C=CC=C3)C4=CC5=C(C=C4)OCCCO5

InChI

InChI=1S/C24H24N2O3/c27-24(18-6-9-20(10-7-18)25-12-1-2-13-25)26-14-3-5-21(26)19-8-11-22-23(17-19)29-16-4-15-28-22/h1-2,6-13,17,21H,3-5,14-16H2/t21-/m1/s1