ethyl 1-[(4-carbamimidoylphenyl)methyl]indole-2-carboxylate

Systemtic Name: ethyl 1-[(4-carbamimidoylphenyl)methyl]indole-2-carboxylate Openeye Name: ethyl 1-[(4-carbamimidoylphenyl)methyl]indole-2-carboxylate CAS Name: 1-[(4-carbamimidoylphenyl)methyl]-2-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(4-carbamimidoylphenyl)methyl]indole-2-carboxylate Traditional Name: 1-(4-amidinobenzyl)indole-2-carboxylic acid ethyl ester Formula: C19H19N3O2 MolecularWeight: 321.37306

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=CC=CC=C2N1CC3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CCOC(=O)C1=CC2=CC=CC=C2N1CC3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C19H19N3O2/c1-2-24-19(23)17-11-15-5-3-4-6-16(15)22(17)12-13-7-9-14(10-8-13)18(20)21/h3-11H,2,12H2,1H3,(H3,20,21)