[2-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-2-oxidanylidene-ethyl] 2-(3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoate

Systemtic Name: [2-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-2-oxidanylidene-ethyl] 2-(3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoate Openeye Name: [2-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-2-oxo-ethyl] 2-(3-oxo-1,4-benzoxazin-4-yl)acetate CAS Name: 2-(3-oxo-1,4-benzoxazin-4-yl)acetic acid [2-(2,5-dimethyl-1-phenethyl-3-pyrrolyl)-2-oxoethyl] ester IUPAC Name: [2-(2,5-dimethyl-1-phenethylpyrrol-3-yl)-2-oxoethyl] 2-(3-oxo-1,4-benzoxazin-4-yl)acetate Traditional Name: 2-(3-keto-1,4-benzoxazin-4-yl)acetic acid [2-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-2-keto-ethyl] ester Formula: C26H26N2O5 MolecularWeight: 446.49504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCC2=CC=CC=C2)C)C(=O)COC(=O)CN3C(=O)COC4=CC=CC=C43

Isomeric SMILES

CC1=CC(=C(N1CCC2=CC=CC=C2)C)C(=O)COC(=O)CN3C(=O)COC4=CC=CC=C43

InChI

InChI=1S/C26H26N2O5/c1-18-14-21(19(2)27(18)13-12-20-8-4-3-5-9-20)23(29)16-33-26(31)15-28-22-10-6-7-11-24(22)32-17-25(28)30/h3-11,14H,12-13,15-17H2,1-2H3