1-(1,3-benzodioxol-5-yl)-3-[4-(cyclopentylamino)-2-oxidanylidene-chromen-3-yl]urea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[4-(cyclopentylamino)-2-oxidanylidene-chromen-3-yl]urea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-[4-(cyclopentylamino)-2-oxo-chromen-3-yl]urea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-[4-(cyclopentylamino)-2-oxo-1-benzopyran-3-yl]urea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-[4-(cyclopentylamino)-2-oxochromen-3-yl]urea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-[4-(cyclopentylamino)-2-keto-chromen-3-yl]urea Formula: C22H21N3O5 MolecularWeight: 407.41924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC2=C(C(=O)OC3=CC=CC=C32)NC(=O)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CCC(C1)NC2=C(C(=O)OC3=CC=CC=C32)NC(=O)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H21N3O5/c26-21-20(25-22(27)24-14-9-10-17-18(11-14)29-12-28-17)19(23-13-5-1-2-6-13)15-7-3-4-8-16(15)30-21/h3-4,7-11,13,23H,1-2,5-6,12H2,(H2,24,25,27)