ethyl 4-[2-(4-carbamimidoylphenyl)-4-oxa-3,8-diazaspiro[4.5]dec-2-en-8-yl]butanoate

Systemtic Name: ethyl 4-[2-(4-carbamimidoylphenyl)-4-oxa-3,8-diazaspiro[4.5]dec-2-en-8-yl]butanoate Openeye Name: ethyl 4-[2-(4-carbamimidoylphenyl)-4-oxa-3,8-diazaspiro[4.5]dec-2-en-8-yl]butanoate CAS Name: 4-[2-(4-carbamimidoylphenyl)-4-oxa-3,8-diazaspiro[4.5]dec-2-en-8-yl]butanoic acid ethyl ester IUPAC Name: ethyl 4-[2-(4-carbamimidoylphenyl)-4-oxa-3,8-diazaspiro[4.5]dec-2-en-8-yl]butanoate Traditional Name: 4-[2-(4-amidinophenyl)-4-oxa-3,8-diazaspiro[4.5]dec-2-en-8-yl]butyric acid ethyl ester Formula: C20H28N4O3 MolecularWeight: 372.46132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCN1CCC2(CC1)CC(=NO2)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CCOC(=O)CCCN1CCC2(CC1)CC(=NO2)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C20H28N4O3/c1-2-26-18(25)4-3-11-24-12-9-20(10-13-24)14-17(23-27-20)15-5-7-16(8-6-15)19(21)22/h5-8H,2-4,9-14H2,1H3,(H3,21,22)