1-[(3-methoxy-4-pentoxy-phenyl)methyl]-7-methyl-indole-2,3-dione

Systemtic Name: 1-[(3-methoxy-4-pentoxy-phenyl)methyl]-7-methyl-indole-2,3-dione Openeye Name: 1-[(3-methoxy-4-pentoxy-phenyl)methyl]-7-methyl-indoline-2,3-dione CAS Name: 1-[(3-methoxy-4-pentoxyphenyl)methyl]-7-methylindole-2,3-dione IUPAC Name: 1-[(3-methoxy-4-pentoxyphenyl)methyl]-7-methylindole-2,3-dione Traditional Name: 1-(4-amoxy-3-methoxy-benzyl)-7-methyl-isatin Formula: C22H25NO4 MolecularWeight: 367.4382

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1)CN2C3=C(C=CC=C3C)C(=O)C2=O)OC

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1)CN2C3=C(C=CC=C3C)C(=O)C2=O)OC

InChI

InChI=1S/C22H25NO4/c1-4-5-6-12-27-18-11-10-16(13-19(18)26-3)14-23-20-15(2)8-7-9-17(20)21(24)22(23)25/h7-11,13H,4-6,12,14H2,1-3H3