N-(3-cyclopentyloxy-4-methoxy-phenyl)-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-(3-cyclopentyloxy-4-methoxy-phenyl)-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-[3-(cyclopentoxy)-4-methoxy-phenyl]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-(3-cyclopentyloxy-4-methoxyphenyl)-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-(3-cyclopentyloxy-4-methoxyphenyl)-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: N-[3-(cyclopentoxy)-4-methoxy-phenyl]-4-keto-3H-phthalazine-1-carboxamide Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2=NNC(=O)C3=CC=CC=C32)OC4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2=NNC(=O)C3=CC=CC=C32)OC4CCCC4

InChI

InChI=1S/C21H21N3O4/c1-27-17-11-10-13(12-18(17)28-14-6-2-3-7-14)22-21(26)19-15-8-4-5-9-16(15)20(25)24-23-19/h4-5,8-12,14H,2-3,6-7H2,1H3,(H,22,26)(H,24,25)