2-[4-[[5-(4-methoxyphenyl)-3-(10-methylanthracen-9-yl)-4,6-bis(oxidanylidene)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-2-yl]methyl]phenyl]ethanamide

Systemtic Name: 2-[4-[[5-(4-methoxyphenyl)-3-(10-methylanthracen-9-yl)-4,6-bis(oxidanylidene)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-2-yl]methyl]phenyl]ethanamide Openeye Name: 2-[4-[[5-(4-methoxyphenyl)-3-(10-methyl-9-anthryl)-4,6-dioxo-3a,6a-dihydro-3H-pyrrolo[3,4-d]isoxazol-2-yl]methyl]phenyl]acetamide CAS Name: 2-[4-[[5-(4-methoxyphenyl)-3-(10-methyl-9-anthracenyl)-4,6-dioxo-3a,6a-dihydro-3H-pyrrolo[3,4-d]isoxazol-2-yl]methyl]phenyl]acetamide IUPAC Name: 2-[4-[[5-(4-methoxyphenyl)-3-(10-methylanthracen-9-yl)-4,6-dioxo-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-2-yl]methyl]phenyl]acetamide Traditional Name: 2-[4-[[4,6-diketo-5-(4-methoxyphenyl)-3-(10-methyl-9-anthryl)-3a,6a-dihydro-3H-pyrrol[3,4-d]isoxazol-2-yl]methyl]phenyl]acetamide Formula: C36H31N3O5 MolecularWeight: 585.64844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=CC=CC2=C(C3=CC=CC=C13)C4C5C(C(=O)N(C5=O)C6=CC=C(C=C6)OC)ON4CC7=CC=C(C=C7)CC(=O)N

Isomeric SMILES

CC1=C2C=CC=CC2=C(C3=CC=CC=C13)C4C5C(C(=O)N(C5=O)C6=CC=C(C=C6)OC)ON4CC7=CC=C(C=C7)CC(=O)N

InChI

InChI=1S/C36H31N3O5/c1-21-26-7-3-5-9-28(26)31(29-10-6-4-8-27(21)29)33-32-34(36(42)39(35(32)41)24-15-17-25(43-2)18-16-24)44-38(33)20-23-13-11-22(12-14-23)19-30(37)40/h3-18,32-34H,19-20H2,1-2H3,(H2,37,40)