(5-acetyloxy-9-ethanoyl-2-methyl-6-phenyl-pyrido[2,3-b]azepin-7-yl) ethanoate

Systemtic Name: (5-acetyloxy-9-ethanoyl-2-methyl-6-phenyl-pyrido[2,3-b]azepin-7-yl) ethanoate Openeye Name: (5-acetoxy-9-acetyl-2-methyl-6-phenyl-pyrido[2,3-b]azepin-7-yl) acetate CAS Name: acetic acid (9-acetyl-5-acetyloxy-2-methyl-6-phenyl-7-pyrido[2,3-b]azepinyl) ester IUPAC Name: (9-acetyl-5-acetyloxy-2-methyl-6-phenylpyrido[2,3-b]azepin-7-yl) acetate Traditional Name: acetic acid (5-acetoxy-9-acetyl-2-methyl-6-phenyl-pyrid[2,3-b]azepin-7-yl) ester Formula: C22H20N2O5 MolecularWeight: 392.4046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C1)C(=C(C(=CN2C(=O)C)OC(=O)C)C3=CC=CC=C3)OC(=O)C

Isomeric SMILES

CC1=NC2=C(C=C1)C(=C(C(=CN2C(=O)C)OC(=O)C)C3=CC=CC=C3)OC(=O)C

InChI

InChI=1S/C22H20N2O5/c1-13-10-11-18-21(29-16(4)27)20(17-8-6-5-7-9-17)19(28-15(3)26)12-24(14(2)25)22(18)23-13/h5-12H,1-4H3