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

Systemtic Name: 4-bromanyl-N-[3-[(2S)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-3-oxidanylidene-propyl]benzamide Openeye Name: 4-bromo-N-[3-[(2S)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-3-oxo-propyl]benzamide CAS Name: 4-bromo-N-[3-[(2S)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-pyrrolidinyl]-3-oxopropyl]benzamide IUPAC Name: 4-bromo-N-[3-[(2S)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-3-oxopropyl]benzamide Traditional Name: 4-bromo-N-[3-[(2S)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidino]-3-keto-propyl]benzamide Formula: C23H25BrN2O4 MolecularWeight: 473.3596

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CCNC(=O)C2=CC=C(C=C2)Br)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

C1C[C@H](N(C1)C(=O)CCNC(=O)C2=CC=C(C=C2)Br)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C23H25BrN2O4/c24-18-7-4-16(5-8-18)23(28)25-11-10-22(27)26-12-1-3-19(26)17-6-9-20-21(15-17)30-14-2-13-29-20/h4-9,15,19H,1-3,10-14H2,(H,25,28)/t19-/m0/s1