(E)-4-[2-[3-(dimethylamino)propoxy]phenoxy]-4-oxidanylidene-but-2-enoate; 1H-indazole

Systemtic Name: (E)-4-[2-[3-(dimethylamino)propoxy]phenoxy]-4-oxidanylidene-but-2-enoate; 1H-indazole Openeye Name: (E)-4-[2-[3-(dimethylamino)propoxy]phenoxy]-4-oxo-but-2-enoate; 1H-indazole CAS Name: (E)-4-[2-[3-(dimethylamino)propoxy]phenoxy]-4-oxo-2-butenoate; 1H-indazole IUPAC Name: (E)-4-[2-[3-(dimethylamino)propoxy]phenoxy]-4-oxobut-2-enoate; 1H-indazole Traditional Name: (E)-4-[2-[3-(dimethylamino)propoxy]phenoxy]-4-keto-but-2-enoate; 1H-indazole Formula: C22H24N3O5- MolecularWeight: 410.44306

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCOC1=CC=CC=C1OC(=O)C=CC(=O)[O-].C1=CC=C2C(=C1)C=NN2

Isomeric SMILES

CN(C)CCCOC1=CC=CC=C1OC(=O)/C=C/C(=O)[O-].C1=CC=C2C(=C1)C=NN2

InChI

InChI=1S/C15H19NO5.C7H6N2/c1-16(2)10-5-11-20-12-6-3-4-7-13(12)21-15(19)9-8-14(17)18;1-2-4-7-6(3-1)5-8-9-7/h3-4,6-9H,5,10-11H2,1-2H3,(H,17,18);1-5H,(H,8,9)/p-1/b9-8+;