methyl 4-[2-(2,7-dimethyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)ethylcarbamoyl]benzoate

Systemtic Name: methyl 4-[2-(2,7-dimethyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)ethylcarbamoyl]benzoate Openeye Name: methyl 4-[2-(2,7-dimethyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)ethylcarbamoyl]benzoate CAS Name: 4-[[2-(2,7-dimethyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)ethylamino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-(2,7-dimethyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)ethylcarbamoyl]benzoate Traditional Name: 4-[2-(2,7-dimethyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)ethylcarbamoyl]benzoic acid methyl ester Formula: C22H26N2O4 MolecularWeight: 382.45284

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC2=C(O1)C=CC(=C2)C)CCNC(=O)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1CN(CC2=C(O1)C=CC(=C2)C)CCNC(=O)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C22H26N2O4/c1-15-4-9-20-19(12-15)14-24(13-16(2)28-20)11-10-23-21(25)17-5-7-18(8-6-17)22(26)27-3/h4-9,12,16H,10-11,13-14H2,1-3H3,(H,23,25)