7-(morpholin-4-ium-4-ylmethyl)-4-(naphthalen-2-ylmethyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-4-ium

Systemtic Name: 7-(morpholin-4-ium-4-ylmethyl)-4-(naphthalen-2-ylmethyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-4-ium Openeye Name: 7-(morpholin-4-ium-4-ylmethyl)-4-(2-naphthylmethyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-4-ium CAS Name: 7-(4-morpholin-4-iumylmethyl)-4-(2-naphthalenylmethyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-4-ium IUPAC Name: 7-(morpholin-4-ium-4-ylmethyl)-4-(naphthalen-2-ylmethyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-4-ium Traditional Name: 7-(morpholin-4-ium-4-ylmethyl)-4-(2-naphthylmethyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-4-ium Formula: C25H30N2O2+2 MolecularWeight: 390.5179

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=CC3=C(C=C2)OCC[NH+](C3)CC4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1COCC[NH+]1CC2=CC3=C(C=C2)OCC[NH+](C3)CC4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C25H28N2O2/c1-2-4-23-15-20(5-7-22(23)3-1)18-27-11-14-29-25-8-6-21(16-24(25)19-27)17-26-9-12-28-13-10-26/h1-8,15-16H,9-14,17-19H2/p+2