methyl 4-[4-(3,5-dihydro-2H-1,4-benzoxazepin-4-ylmethyl)-5-methyl-1,3-oxazol-2-yl]benzoate

Systemtic Name: methyl 4-[4-(3,5-dihydro-2H-1,4-benzoxazepin-4-ylmethyl)-5-methyl-1,3-oxazol-2-yl]benzoate Openeye Name: methyl 4-[4-(3,5-dihydro-2H-1,4-benzoxazepin-4-ylmethyl)-5-methyl-oxazol-2-yl]benzoate CAS Name: 4-[4-(3,5-dihydro-2H-1,4-benzoxazepin-4-ylmethyl)-5-methyl-2-oxazolyl]benzoic acid methyl ester IUPAC Name: methyl 4-[4-(3,5-dihydro-2H-1,4-benzoxazepin-4-ylmethyl)-5-methyl-1,3-oxazol-2-yl]benzoate Traditional Name: 4-[4-(3,5-dihydro-2H-1,4-benzoxazepin-4-ylmethyl)-5-methyl-oxazol-2-yl]benzoic acid methyl ester Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=C(C=C2)C(=O)OC)CN3CCOC4=CC=CC=C4C3

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=C(C=C2)C(=O)OC)CN3CCOC4=CC=CC=C4C3

InChI

InChI=1S/C22H22N2O4/c1-15-19(14-24-11-12-27-20-6-4-3-5-18(20)13-24)23-21(28-15)16-7-9-17(10-8-16)22(25)26-2/h3-10H,11-14H2,1-2H3