ethyl 4-iodanyl-3-[[(phenylmethyl)amino]methyl]indole-1-carboxylate

Systemtic Name: ethyl 4-iodanyl-3-[[(phenylmethyl)amino]methyl]indole-1-carboxylate Openeye Name: ethyl 3-[(benzylamino)methyl]-4-iodo-indole-1-carboxylate CAS Name: 4-iodo-3-[[(phenylmethyl)amino]methyl]-1-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(benzylamino)methyl]-4-iodoindole-1-carboxylate Traditional Name: 3-[(benzylamino)methyl]-4-iodo-indole-1-carboxylic acid ethyl ester Formula: C19H19IN2O2 MolecularWeight: 434.27083

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C=C(C2=C1C=CC=C2I)CNCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)N1C=C(C2=C1C=CC=C2I)CNCC3=CC=CC=C3

InChI

InChI=1S/C19H19IN2O2/c1-2-24-19(23)22-13-15(18-16(20)9-6-10-17(18)22)12-21-11-14-7-4-3-5-8-14/h3-10,13,21H,2,11-12H2,1H3