6-[3-(cyclopropylmethoxy)-4-ethoxy-phenyl]-9-ethoxy-8-methoxy-1,2,3,4,4a,10b-hexahydrophenanthridine

Systemtic Name: 6-[3-(cyclopropylmethoxy)-4-ethoxy-phenyl]-9-ethoxy-8-methoxy-1,2,3,4,4a,10b-hexahydrophenanthridine Openeye Name: 6-[3-(cyclopropylmethoxy)-4-ethoxy-phenyl]-9-ethoxy-8-methoxy-1,2,3,4,4a,10b-hexahydrophenanthridine CAS Name: 6-[3-(cyclopropylmethoxy)-4-ethoxyphenyl]-9-ethoxy-8-methoxy-1,2,3,4,4a,10b-hexahydrophenanthridine IUPAC Name: 6-[3-(cyclopropylmethoxy)-4-ethoxyphenyl]-9-ethoxy-8-methoxy-1,2,3,4,4a,10b-hexahydrophenanthridine Traditional Name: 6-[3-(cyclopropylmethoxy)-4-ethoxy-phenyl]-9-ethoxy-8-methoxy-1,2,3,4,4a,10b-hexahydrophenanthridine Formula: C28H35NO4 MolecularWeight: 449.5818

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=NC3CCCCC3C4=CC(=C(C=C42)OC)OCC)OCC5CC5

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=NC3CCCCC3C4=CC(=C(C=C42)OC)OCC)OCC5CC5

InChI

InChI=1S/C28H35NO4/c1-4-31-24-13-12-19(14-26(24)33-17-18-10-11-18)28-22-16-25(30-3)27(32-5-2)15-21(22)20-8-6-7-9-23(20)29-28/h12-16,18,20,23H,4-11,17H2,1-3H3