(4S)-4-[[7-(pyrrolidin-1-ium-1-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]carbonyl]pyrrolidin-2-one

Systemtic Name: (4S)-4-[[7-(pyrrolidin-1-ium-1-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]carbonyl]pyrrolidin-2-one Openeye Name: (4S)-4-[7-(pyrrolidin-1-ium-1-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepine-4-carbonyl]pyrrolidin-2-one CAS Name: (4S)-4-[oxo-[7-(1-pyrrolidin-1-iumylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methyl]-2-pyrrolidinone IUPAC Name: (4S)-4-[7-(pyrrolidin-1-ium-1-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepine-4-carbonyl]pyrrolidin-2-one Traditional Name: (4S)-4-[7-(pyrrolidin-1-ium-1-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepine-4-carbonyl]-2-pyrrolidone Formula: C19H26N3O3+ MolecularWeight: 344.42804

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CC3=C(C=C2)OCCN(C3)C(=O)C4CC(=O)NC4

Isomeric SMILES

C1CC[NH+](C1)CC2=CC3=C(C=C2)OCCN(C3)C(=O)[C@H]4CC(=O)NC4

InChI

InChI=1S/C19H25N3O3/c23-18-10-15(11-20-18)19(24)22-7-8-25-17-4-3-14(9-16(17)13-22)12-21-5-1-2-6-21/h3-4,9,15H,1-2,5-8,10-13H2,(H,20,23)/p+1/t15-/m0/s1