(7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl 4-(1H-indol-3-yl)butanoate

Systemtic Name: (7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl 4-(1H-indol-3-yl)butanoate Openeye Name: (6-isopropyl-7-methyl-2-oxo-chromen-4-yl)methyl 4-(1H-indol-3-yl)butanoate CAS Name: 4-(1H-indol-3-yl)butanoic acid (7-methyl-2-oxo-6-propan-2-yl-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methyl-2-oxo-6-propan-2-ylchromen-4-yl)methyl 4-(1H-indol-3-yl)butanoate Traditional Name: 4-(1H-indol-3-yl)butyric acid (6-isopropyl-2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C26H27NO4 MolecularWeight: 417.49688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)CCCC3=CNC4=CC=CC=C43)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)CCCC3=CNC4=CC=CC=C43)C(C)C

InChI

InChI=1S/C26H27NO4/c1-16(2)21-13-22-19(12-26(29)31-24(22)11-17(21)3)15-30-25(28)10-6-7-18-14-27-23-9-5-4-8-20(18)23/h4-5,8-9,11-14,16,27H,6-7,10,15H2,1-3H3