methyl 2-[[7-(morpholin-4-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]carbonyl]benzoate

Systemtic Name: methyl 2-[[7-(morpholin-4-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]carbonyl]benzoate Openeye Name: methyl 2-[7-(morpholinomethyl)-3,5-dihydro-2H-1,4-benzoxazepine-4-carbonyl]benzoate CAS Name: 2-[[7-(4-morpholinylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 2-[7-(morpholin-4-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepine-4-carbonyl]benzoate Traditional Name: 2-[7-(morpholinomethyl)-3,5-dihydro-2H-1,4-benzoxazepine-4-carbonyl]benzoic acid methyl ester Formula: C23H26N2O5 MolecularWeight: 410.46294

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1C(=O)N2CCOC3=C(C2)C=C(C=C3)CN4CCOCC4

Isomeric SMILES

COC(=O)C1=CC=CC=C1C(=O)N2CCOC3=C(C2)C=C(C=C3)CN4CCOCC4

InChI

InChI=1S/C23H26N2O5/c1-28-23(27)20-5-3-2-4-19(20)22(26)25-10-13-30-21-7-6-17(14-18(21)16-25)15-24-8-11-29-12-9-24/h2-7,14H,8-13,15-16H2,1H3