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

Systemtic Name: 6-(3-methyl-4-oxidanyl-phenyl)-5,6,6a,7,8,12b-hexahydrobenzo[k]phenanthridine-2-carboximidamide Openeye Name: 6-(4-hydroxy-3-methyl-phenyl)-5,6,6a,7,8,12b-hexahydrobenzo[k]phenanthridine-2-carboxamidine CAS Name: 6-(4-hydroxy-3-methylphenyl)-5,6,6a,7,8,12b-hexahydrobenzo[k]phenanthridine-2-carboximidamide IUPAC Name: 6-(4-hydroxy-3-methylphenyl)-5,6,6a,7,8,12b-hexahydrobenzo[k]phenanthridine-2-carboximidamide Traditional Name: 6-(4-hydroxy-3-methyl-phenyl)-5,6,6a,7,8,12b-hexahydrobenzo[k]phenanthridine-2-carboxamidine Formula: C25H25N3O MolecularWeight: 383.4855

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2C3CCC4=CC=CC=C4C3C5=C(N2)C=CC(=C5)C(=N)N)O

Isomeric SMILES

CC1=C(C=CC(=C1)C2C3CCC4=CC=CC=C4C3C5=C(N2)C=CC(=C5)C(=N)N)O

InChI

InChI=1S/C25H25N3O/c1-14-12-16(8-11-22(14)29)24-19-9-6-15-4-2-3-5-18(15)23(19)20-13-17(25(26)27)7-10-21(20)28-24/h2-5,7-8,10-13,19,23-24,28-29H,6,9H2,1H3,(H3,26,27)