3-(2-imidazol-1-ylethyl)-1-phenyl-6,7,8,9,10,11-hexahydrocycloocta[g]phthalazin-4-one

Systemtic Name: 3-(2-imidazol-1-ylethyl)-1-phenyl-6,7,8,9,10,11-hexahydrocycloocta[g]phthalazin-4-one Openeye Name: 3-(2-imidazol-1-ylethyl)-1-phenyl-6,7,8,9,10,11-hexahydrocycloocta[g]phthalazin-4-one CAS Name: 3-[2-(1-imidazolyl)ethyl]-1-phenyl-6,7,8,9,10,11-hexahydrocycloocta[g]phthalazin-4-one IUPAC Name: 3-(2-imidazol-1-ylethyl)-1-phenyl-6,7,8,9,10,11-hexahydrocycloocta[g]phthalazin-4-one Traditional Name: 3-(2-imidazol-1-ylethyl)-1-phenyl-6,7,8,9,10,11-hexahydrocycloocta[g]phthalazin-4-one Formula: C25H26N4O MolecularWeight: 398.50014

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC2=C(CC1)C=C3C(=C2)C(=O)N(N=C3C4=CC=CC=C4)CCN5C=CN=C5

Isomeric SMILES

C1CCCC2=C(CC1)C=C3C(=C2)C(=O)N(N=C3C4=CC=CC=C4)CCN5C=CN=C5

InChI

InChI=1S/C25H26N4O/c30-25-23-17-21-11-5-2-1-4-10-20(21)16-22(23)24(19-8-6-3-7-9-19)27-29(25)15-14-28-13-12-26-18-28/h3,6-9,12-13,16-18H,1-2,4-5,10-11,14-15H2