6-(3-methoxy-4-oxidanyl-phenyl)-9-oxidanyl-5,6,6a,7,8,12b-hexahydrobenzo[k]phenanthridine-2-carboximidamide

Systemtic Name: 6-(3-methoxy-4-oxidanyl-phenyl)-9-oxidanyl-5,6,6a,7,8,12b-hexahydrobenzo[k]phenanthridine-2-carboximidamide Openeye Name: 9-hydroxy-6-(4-hydroxy-3-methoxy-phenyl)-5,6,6a,7,8,12b-hexahydrobenzo[k]phenanthridine-2-carboxamidine CAS Name: 9-hydroxy-6-(4-hydroxy-3-methoxyphenyl)-5,6,6a,7,8,12b-hexahydrobenzo[k]phenanthridine-2-carboximidamide IUPAC Name: 9-hydroxy-6-(4-hydroxy-3-methoxyphenyl)-5,6,6a,7,8,12b-hexahydrobenzo[k]phenanthridine-2-carboximidamide Traditional Name: 9-hydroxy-6-(4-hydroxy-3-methoxy-phenyl)-5,6,6a,7,8,12b-hexahydrobenzo[k]phenanthridine-2-carboxamidine Formula: C25H25N3O3 MolecularWeight: 415.4843

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2C3CCC4=C(C3C5=C(N2)C=CC(=C5)C(=N)N)C=CC=C4O)O

Isomeric SMILES

COC1=C(C=CC(=C1)C2C3CCC4=C(C3C5=C(N2)C=CC(=C5)C(=N)N)C=CC=C4O)O

InChI

InChI=1S/C25H25N3O3/c1-31-22-12-13(6-10-21(22)30)24-17-8-7-15-16(3-2-4-20(15)29)23(17)18-11-14(25(26)27)5-9-19(18)28-24/h2-6,9-12,17,23-24,28-30H,7-8H2,1H3,(H3,26,27)