ethyl 2-[4-[3-[(4-carbamimidoylphenyl)amino]-3-oxidanylidene-propyl]piperazin-1-yl]ethanoate

Systemtic Name: ethyl 2-[4-[3-[(4-carbamimidoylphenyl)amino]-3-oxidanylidene-propyl]piperazin-1-yl]ethanoate Openeye Name: ethyl 2-[4-[3-(4-carbamimidoylanilino)-3-oxo-propyl]piperazin-1-yl]acetate CAS Name: 2-[4-[3-(4-carbamimidoylanilino)-3-oxopropyl]-1-piperazinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[3-(4-carbamimidoylanilino)-3-oxopropyl]piperazin-1-yl]acetate Traditional Name: 2-[4-[3-(4-amidinoanilino)-3-keto-propyl]piperazino]acetic acid ethyl ester Formula: C18H27N5O3 MolecularWeight: 361.43868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1CCN(CC1)CCC(=O)NC2=CC=C(C=C2)C(=N)N

Isomeric SMILES

CCOC(=O)CN1CCN(CC1)CCC(=O)NC2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C18H27N5O3/c1-2-26-17(25)13-23-11-9-22(10-12-23)8-7-16(24)21-15-5-3-14(4-6-15)18(19)20/h3-6H,2,7-13H2,1H3,(H3,19,20)(H,21,24)