(4-cyano-2-methoxy-phenyl) (6S)-6-methyl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxylate

Systemtic Name: (4-cyano-2-methoxy-phenyl) (6S)-6-methyl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxylate Openeye Name: (4-cyano-2-methoxy-phenyl) (6S)-6-methyl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxylate CAS Name: (6S)-6-methyl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxylic acid (4-cyano-2-methoxyphenyl) ester IUPAC Name: (4-cyano-2-methoxyphenyl) (6S)-6-methyl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxylate Traditional Name: (6S)-6-methyl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxylic acid (4-cyano-2-methoxy-phenyl) ester Formula: C22H20N2O3 MolecularWeight: 360.4058

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C3=C(N2)C=CC(=C3)C(=O)OC4=C(C=C(C=C4)C#N)OC

Isomeric SMILES

C[C@H]1CCC2=C(C1)C3=C(N2)C=CC(=C3)C(=O)OC4=C(C=C(C=C4)C#N)OC

InChI

InChI=1S/C22H20N2O3/c1-13-3-6-18-16(9-13)17-11-15(5-7-19(17)24-18)22(25)27-20-8-4-14(12-23)10-21(20)26-2/h4-5,7-8,10-11,13,24H,3,6,9H2,1-2H3/t13-/m0/s1