tert-butyl 4-[(6-azanylindol-1-yl)methyl]-3-methoxy-benzoate

Systemtic Name: tert-butyl 4-[(6-azanylindol-1-yl)methyl]-3-methoxy-benzoate Openeye Name: tert-butyl 4-[(6-aminoindol-1-yl)methyl]-3-methoxy-benzoate CAS Name: 4-[(6-amino-1-indolyl)methyl]-3-methoxybenzoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(6-aminoindol-1-yl)methyl]-3-methoxybenzoate Traditional Name: 4-[(6-aminoindol-1-yl)methyl]-3-methoxy-benzoic acid tert-butyl ester Formula: C21H24N2O3 MolecularWeight: 352.42686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC(=C(C=C1)CN2C=CC3=C2C=C(C=C3)N)OC

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC(=C(C=C1)CN2C=CC3=C2C=C(C=C3)N)OC

InChI

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