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

Systemtic Name: ethyl 4-[2-(4-carbamimidoylphenyl)-3-oxidanylidene-4-oxa-2,8-diazaspiro[4.5]decan-8-yl]butanoate Openeye Name: ethyl 4-[2-(4-carbamimidoylphenyl)-3-oxo-4-oxa-2,8-diazaspiro[4.5]decan-8-yl]butanoate CAS Name: 4-[2-(4-carbamimidoylphenyl)-3-oxo-4-oxa-2,8-diazaspiro[4.5]decan-8-yl]butanoic acid ethyl ester IUPAC Name: ethyl 4-[2-(4-carbamimidoylphenyl)-3-oxo-4-oxa-2,8-diazaspiro[4.5]decan-8-yl]butanoate Traditional Name: 4-[2-(4-amidinophenyl)-3-keto-4-oxa-2,8-diazaspiro[4.5]decan-8-yl]butyric acid ethyl ester Formula: C20H28N4O4 MolecularWeight: 388.46072

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCN1CCC2(CC1)CN(C(=O)O2)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CCOC(=O)CCCN1CCC2(CC1)CN(C(=O)O2)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C20H28N4O4/c1-2-27-17(25)4-3-11-23-12-9-20(10-13-23)14-24(19(26)28-20)16-7-5-15(6-8-16)18(21)22/h5-8H,2-4,9-14H2,1H3,(H3,21,22)