[(4-carbamimidoylphenyl)amino] 2-[3-ethyl-5-(2-pyrrolidin-1-ylethoxy)phenyl]ethanoate

Systemtic Name: [(4-carbamimidoylphenyl)amino] 2-[3-ethyl-5-(2-pyrrolidin-1-ylethoxy)phenyl]ethanoate Openeye Name: (4-carbamimidoylanilino) 2-[3-ethyl-5-(2-pyrrolidin-1-ylethoxy)phenyl]acetate CAS Name: 2-[3-ethyl-5-[2-(1-pyrrolidinyl)ethoxy]phenyl]acetic acid (4-carbamimidoylanilino) ester IUPAC Name: (4-carbamimidoylanilino) 2-[3-ethyl-5-(2-pyrrolidin-1-ylethoxy)phenyl]acetate Traditional Name: 2-[3-ethyl-5-(2-pyrrolidinoethoxy)phenyl]acetic acid (4-amidinoanilino) ester Formula: C23H30N4O3 MolecularWeight: 410.5093

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC(=C1)CC(=O)ONC2=CC=C(C=C2)C(=N)N)OCCN3CCCC3

Isomeric SMILES

CCC1=CC(=CC(=C1)CC(=O)ONC2=CC=C(C=C2)C(=N)N)OCCN3CCCC3

InChI

InChI=1S/C23H30N4O3/c1-2-17-13-18(15-21(14-17)29-12-11-27-9-3-4-10-27)16-22(28)30-26-20-7-5-19(6-8-20)23(24)25/h5-8,13-15,26H,2-4,9-12,16H2,1H3,(H3,24,25)