(6aR,12bS)-3-methyl-6-propyl-6a,7,8,12b-tetrahydro-5H-benzo[a]phenanthridine-10,11-diol

Systemtic Name: (6aR,12bS)-3-methyl-6-propyl-6a,7,8,12b-tetrahydro-5H-benzo[a]phenanthridine-10,11-diol Openeye Name: (6aR,12bS)-3-methyl-6-propyl-6a,7,8,12b-tetrahydro-5H-benzo[a]phenanthridine-10,11-diol CAS Name: (6aR,12bS)-3-methyl-6-propyl-6a,7,8,12b-tetrahydro-5H-benzo[a]phenanthridine-10,11-diol IUPAC Name: (6aR,12bS)-3-methyl-6-propyl-6a,7,8,12b-tetrahydro-5H-benzo[a]phenanthridine-10,11-diol Traditional Name: (6aR,12bS)-3-methyl-6-propyl-6a,7,8,12b-tetrahydro-5H-benzo[a]phenanthridine-10,11-diol Formula: C21H25NO2 MolecularWeight: 323.4287

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CC2=C(C=CC(=C2)C)C3C1CCC4=CC(=C(C=C34)O)O

Isomeric SMILES

CCCN1CC2=C(C=CC(=C2)C)[C@H]3[C@H]1CCC4=CC(=C(C=C34)O)O

InChI

InChI=1S/C21H25NO2/c1-3-8-22-12-15-9-13(2)4-6-16(15)21-17-11-20(24)19(23)10-14(17)5-7-18(21)22/h4,6,9-11,18,21,23-24H,3,5,7-8,12H2,1-2H3/t18-,21-/m1/s1