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

Systemtic Name: 2-(2-dimethylaminoethyl)-4-[(4-methylphenyl)methyl]-2,3-dihydro-1,4-benzoxazepin-5-one; ethanedioic acid Openeye Name: 2-(2-dimethylaminoethyl)-4-(p-tolylmethyl)-2,3-dihydro-1,4-benzoxazepin-5-one; oxalic acid CAS Name: 2-(2-dimethylaminoethyl)-4-[(4-methylphenyl)methyl]-2,3-dihydro-1,4-benzoxazepin-5-one; oxalic acid IUPAC Name: 2-(2-dimethylaminoethyl)-4-[(4-methylphenyl)methyl]-2,3-dihydro-1,4-benzoxazepin-5-one; oxalic acid Traditional Name: 2-(2-dimethylaminoethyl)-4-(4-methylbenzyl)-2,3-dihydro-1,4-benzoxazepin-5-one; oxalic acid Formula: C23H28N2O6 MolecularWeight: 428.47822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CC(OC3=CC=CC=C3C2=O)CCN(C)C.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC=C(C=C1)CN2CC(OC3=CC=CC=C3C2=O)CCN(C)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C21H26N2O2.C2H2O4/c1-16-8-10-17(11-9-16)14-23-15-18(12-13-22(2)3)25-20-7-5-4-6-19(20)21(23)24;3-1(4)2(5)6/h4-11,18H,12-15H2,1-3H3;(H,3,4)(H,5,6)