9-methoxy-7-(8-methoxy-4-methyl-quinolin-2-yl)-4-propan-2-yl-2,3,4,5-tetrahydro-1,4-benzoxazepin-4-ium

Systemtic Name: 9-methoxy-7-(8-methoxy-4-methyl-quinolin-2-yl)-4-propan-2-yl-2,3,4,5-tetrahydro-1,4-benzoxazepin-4-ium Openeye Name: 4-isopropyl-9-methoxy-7-(8-methoxy-4-methyl-2-quinolyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-4-ium CAS Name: 9-methoxy-7-(8-methoxy-4-methyl-2-quinolinyl)-4-propan-2-yl-2,3,4,5-tetrahydro-1,4-benzoxazepin-4-ium IUPAC Name: 9-methoxy-7-(8-methoxy-4-methylquinolin-2-yl)-4-propan-2-yl-2,3,4,5-tetrahydro-1,4-benzoxazepin-4-ium Traditional Name: 4-isopropyl-9-methoxy-7-(8-methoxy-4-methyl-2-quinolyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-4-ium Formula: C24H29N2O3+ MolecularWeight: 393.49866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=CC=C2OC)C3=CC4=C(C(=C3)OC)OCC[NH+](C4)C(C)C

Isomeric SMILES

CC1=CC(=NC2=C1C=CC=C2OC)C3=CC4=C(C(=C3)OC)OCC[NH+](C4)C(C)C

InChI

InChI=1S/C24H28N2O3/c1-15(2)26-9-10-29-24-18(14-26)12-17(13-22(24)28-5)20-11-16(3)19-7-6-8-21(27-4)23(19)25-20/h6-8,11-13,15H,9-10,14H2,1-5H3/p+1