methyl (8R,12S)-9,9-dimethyl-11-oxidanylidene-12-pyridin-3-yl-7,8,10,12-tetrahydrobenzo[a]acridine-8-carboxylate

Systemtic Name: methyl (8R,12S)-9,9-dimethyl-11-oxidanylidene-12-pyridin-3-yl-7,8,10,12-tetrahydrobenzo[a]acridine-8-carboxylate Openeye Name: methyl (8R,12S)-9,9-dimethyl-11-oxo-12-(3-pyridyl)-7,8,10,12-tetrahydrobenzo[a]acridine-8-carboxylate CAS Name: (8R,12S)-9,9-dimethyl-11-oxo-12-(3-pyridinyl)-7,8,10,12-tetrahydrobenzo[a]acridine-8-carboxylic acid methyl ester IUPAC Name: methyl (8R,12S)-9,9-dimethyl-11-oxo-12-pyridin-3-yl-7,8,10,12-tetrahydrobenzo[a]acridine-8-carboxylate Traditional Name: (8R,12S)-11-keto-9,9-dimethyl-12-(3-pyridyl)-7,8,10,12-tetrahydrobenz[a]acridine-8-carboxylic acid methyl ester Formula: C26H24N2O3 MolecularWeight: 412.48036

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C2=C(C1C(=O)OC)NC3=C(C2C4=CN=CC=C4)C5=CC=CC=C5C=C3)C

Isomeric SMILES

CC1(CC(=O)C2=C([C@@H]1C(=O)OC)NC3=C([C@@H]2C4=CN=CC=C4)C5=CC=CC=C5C=C3)C

InChI

InChI=1S/C26H24N2O3/c1-26(2)13-19(29)22-20(16-8-6-12-27-14-16)21-17-9-5-4-7-15(17)10-11-18(21)28-24(22)23(26)25(30)31-3/h4-12,14,20,23,28H,13H2,1-3H3/t20-,23+/m0/s1