phenethyl 2-(10-methyl-11-oxidanylidene-6H-benzo[c][1]benzoxepin-3-yl)ethanoate

Systemtic Name: phenethyl 2-(10-methyl-11-oxidanylidene-6H-benzo[c][1]benzoxepin-3-yl)ethanoate Openeye Name: phenethyl 2-(10-methyl-11-oxo-6H-benzo[c][1]benzoxepin-3-yl)acetate CAS Name: 2-(10-methyl-11-oxo-6H-benzo[c][1]benzoxepin-3-yl)acetic acid phenethyl ester IUPAC Name: phenethyl 2-(10-methyl-11-oxo-6H-benzo[c][1]benzoxepin-3-yl)acetate Traditional Name: 2-(11-keto-10-methyl-6H-benzo[c][1]benzoxepin-3-yl)acetic acid phenethyl ester Formula: C25H22O4 MolecularWeight: 386.43978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1C(=O)C3=C(C=C(C=C3)CC(=O)OCCC4=CC=CC=C4)OC2

Isomeric SMILES

CC1=CC=CC2=C1C(=O)C3=C(C=C(C=C3)CC(=O)OCCC4=CC=CC=C4)OC2

InChI

InChI=1S/C25H22O4/c1-17-6-5-9-20-16-29-22-14-19(10-11-21(22)25(27)24(17)20)15-23(26)28-13-12-18-7-3-2-4-8-18/h2-11,14H,12-13,15-16H2,1H3