tert-butyl 2-azanyl-7a-methyl-5-oxidanylidene-1-(phenylmethyl)indole-3-carboxylate

Systemtic Name: tert-butyl 2-azanyl-7a-methyl-5-oxidanylidene-1-(phenylmethyl)indole-3-carboxylate Openeye Name: tert-butyl 2-amino-1-benzyl-7a-methyl-5-oxo-indole-3-carboxylate CAS Name: 2-amino-7a-methyl-5-oxo-1-(phenylmethyl)-3-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-amino-1-benzyl-7a-methyl-5-oxoindole-3-carboxylate Traditional Name: 2-amino-1-benzyl-5-keto-7a-methyl-indole-3-carboxylic acid tert-butyl ester Formula: C21H24N2O3 MolecularWeight: 352.42686

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Descriptors Computed from Structure

Canonical SMILES:

CC12C=CC(=O)C=C1C(=C(N2CC3=CC=CC=C3)N)C(=O)OC(C)(C)C

Isomeric SMILES

CC12C=CC(=O)C=C1C(=C(N2CC3=CC=CC=C3)N)C(=O)OC(C)(C)C

InChI

InChI=1S/C21H24N2O3/c1-20(2,3)26-19(25)17-16-12-15(24)10-11-21(16,4)23(18(17)22)13-14-8-6-5-7-9-14/h5-12H,13,22H2,1-4H3