2-(2-dimethylaminoethyl)-4-methyl-2,3-dihydrobenzo[h][1,4]benzoxazepin-5-one; ethanedioic acid

Systemtic Name: 2-(2-dimethylaminoethyl)-4-methyl-2,3-dihydrobenzo[h][1,4]benzoxazepin-5-one; ethanedioic acid Openeye Name: 2-(2-dimethylaminoethyl)-4-methyl-2,3-dihydrobenzo[h][1,4]benzoxazepin-5-one; oxalic acid CAS Name: 2-(2-dimethylaminoethyl)-4-methyl-2,3-dihydrobenzo[h][1,4]benzoxazepin-5-one; oxalic acid IUPAC Name: 2-(2-dimethylaminoethyl)-4-methyl-2,3-dihydrobenzo[h][1,4]benzoxazepin-5-one; oxalic acid Traditional Name: 2-(2-dimethylaminoethyl)-4-methyl-2,3-dihydrobenzo[h][1,4]benzoxazepin-5-one; oxalic acid Formula: C20H24N2O6 MolecularWeight: 388.41436

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC(OC2=CC3=CC=CC=C3C=C2C1=O)CCN(C)C.C(=O)(C(=O)O)O

Isomeric SMILES

CN1CC(OC2=CC3=CC=CC=C3C=C2C1=O)CCN(C)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H22N2O2.C2H2O4/c1-19(2)9-8-15-12-20(3)18(21)16-10-13-6-4-5-7-14(13)11-17(16)22-15;3-1(4)2(5)6/h4-7,10-11,15H,8-9,12H2,1-3H3;(H,3,4)(H,5,6)