methyl 4-(8,9-dimethoxy-1,2,3,4,4a,10b-hexahydrophenanthridin-6-yl)benzoate

Systemtic Name: methyl 4-(8,9-dimethoxy-1,2,3,4,4a,10b-hexahydrophenanthridin-6-yl)benzoate Openeye Name: methyl 4-(8,9-dimethoxy-1,2,3,4,4a,10b-hexahydrophenanthridin-6-yl)benzoate CAS Name: 4-(8,9-dimethoxy-1,2,3,4,4a,10b-hexahydrophenanthridin-6-yl)benzoic acid methyl ester IUPAC Name: methyl 4-(8,9-dimethoxy-1,2,3,4,4a,10b-hexahydrophenanthridin-6-yl)benzoate Traditional Name: 4-(8,9-dimethoxy-1,2,3,4,4a,10b-hexahydrophenanthridin-6-yl)benzoic acid methyl ester Formula: C23H25NO4 MolecularWeight: 379.4489

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C3CCCCC3N=C2C4=CC=C(C=C4)C(=O)OC)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C3CCCCC3N=C2C4=CC=C(C=C4)C(=O)OC)OC

InChI

InChI=1S/C23H25NO4/c1-26-20-12-17-16-6-4-5-7-19(16)24-22(18(17)13-21(20)27-2)14-8-10-15(11-9-14)23(25)28-3/h8-13,16,19H,4-7H2,1-3H3