ethyl 2-[[7-ethanoyl-1-[(2-hydroxyphenyl)methyl]-3,6-dihydro-2H-azepin-7-yl]carbonylamino]ethanoate

Systemtic Name: ethyl 2-[[7-ethanoyl-1-[(2-hydroxyphenyl)methyl]-3,6-dihydro-2H-azepin-7-yl]carbonylamino]ethanoate Openeye Name: ethyl 2-[[7-acetyl-1-[(2-hydroxyphenyl)methyl]-3,6-dihydro-2H-azepine-7-carbonyl]amino]acetate CAS Name: 2-[[[7-acetyl-1-[(2-hydroxyphenyl)methyl]-3,6-dihydro-2H-azepin-7-yl]-oxomethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[7-acetyl-1-[(2-hydroxyphenyl)methyl]-3,6-dihydro-2H-azepine-7-carbonyl]amino]acetate Traditional Name: 2-[(7-acetyl-1-salicyl-3,6-dihydro-2H-azepine-7-carbonyl)amino]acetic acid ethyl ester Formula: C20H26N2O5 MolecularWeight: 374.43084

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)C1(CC=CCCN1CC2=CC=CC=C2O)C(=O)C

Isomeric SMILES

CCOC(=O)CNC(=O)C1(CC=CCCN1CC2=CC=CC=C2O)C(=O)C

InChI

InChI=1S/C20H26N2O5/c1-3-27-18(25)13-21-19(26)20(15(2)23)11-7-4-8-12-22(20)14-16-9-5-6-10-17(16)24/h4-7,9-10,24H,3,8,11-14H2,1-2H3,(H,21,26)