[(4-carbamimidoylphenyl)amino] 2-[2-(2-dimethylaminoethyloxy)-5-ethyl-phenyl]ethanoate

Systemtic Name: [(4-carbamimidoylphenyl)amino] 2-[2-(2-dimethylaminoethyloxy)-5-ethyl-phenyl]ethanoate Openeye Name: (4-carbamimidoylanilino) 2-[2-(2-dimethylaminoethyloxy)-5-ethyl-phenyl]acetate CAS Name: 2-[2-(2-dimethylaminoethyloxy)-5-ethylphenyl]acetic acid (4-carbamimidoylanilino) ester IUPAC Name: (4-carbamimidoylanilino) 2-[2-(2-dimethylaminoethyloxy)-5-ethylphenyl]acetate Traditional Name: 2-[2-(2-dimethylaminoethyloxy)-5-ethyl-phenyl]acetic acid (4-amidinoanilino) ester Formula: C21H28N4O3 MolecularWeight: 384.47202

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OCCN(C)C)CC(=O)ONC2=CC=C(C=C2)C(=N)N

Isomeric SMILES

CCC1=CC(=C(C=C1)OCCN(C)C)CC(=O)ONC2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C21H28N4O3/c1-4-15-5-10-19(27-12-11-25(2)3)17(13-15)14-20(26)28-24-18-8-6-16(7-9-18)21(22)23/h5-10,13,24H,4,11-12,14H2,1-3H3,(H3,22,23)