ethyl (3S,4R)-6-bromanyl-4-methyl-1-oxidanylidene-2,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylate

Systemtic Name: ethyl (3S,4R)-6-bromanyl-4-methyl-1-oxidanylidene-2,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylate Openeye Name: ethyl (3S,4R)-6-bromo-4-methyl-1-oxo-2,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylate CAS Name: (3S,4R)-6-bromo-4-methyl-1-oxo-2,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylic acid ethyl ester IUPAC Name: ethyl (3S,4R)-6-bromo-4-methyl-1-oxo-2,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylate Traditional Name: (3S,4R)-6-bromo-1-keto-4-methyl-2,3,4,9-tetrahydro-$b-carboline-3-carboxylic acid ethyl ester Formula: C15H15BrN2O3 MolecularWeight: 351.1952

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(C2=C(C(=O)N1)NC3=C2C=C(C=C3)Br)C

Isomeric SMILES

CCOC(=O)[C@@H]1[C@@H](C2=C(C(=O)N1)NC3=C2C=C(C=C3)Br)C

InChI

InChI=1S/C15H15BrN2O3/c1-3-21-15(20)12-7(2)11-9-6-8(16)4-5-10(9)17-13(11)14(19)18-12/h4-7,12,17H,3H2,1-2H3,(H,18,19)/t7-,12+/m1/s1