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(phenylmethyl) 2-[4-[[bis(azanyl)methylideneamino]methyl]cyclohexyl]carbonyloxybenzoate

(phenylmethyl) 2-[4-[[bis(azanyl)methylideneamino]methyl]cyclohexyl]carbonyloxybenzoate

Systemtic Name:(phenylmethyl) 2-[4-[[bis(azanyl)methylideneamino]methyl]cyclohexyl]carbonyloxybenzoate
Openeye Name:benzyl 2-[4-(guanidinomethyl)cyclohexanecarbonyl]oxybenzoate
CAS Name:2-[[4-[(diaminomethylideneamino)methyl]cyclohexyl]-oxomethoxy]benzoic acid (phenylmethyl) ester
IUPAC Name:benzyl 2-[4-[(diaminomethylideneamino)methyl]cyclohexanecarbonyl]oxybenzoate
Traditional Name:2-[4-(guanidinomethyl)cyclohexanecarbonyl]oxybenzoic acid benzyl ester
Formula: C23H27N3O4
MolecularWeight: 409.47818
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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CN=C(N)N)C(=O)OC2=CC=CC=C2C(=O)OCC3=CC=CC=C3


Isomeric SMILES

C1CC(CCC1CN=C(N)N)C(=O)OC2=CC=CC=C2C(=O)OCC3=CC=CC=C3


InChI

InChI=1S/C23H27N3O4/c24-23(25)26-14-16-10-12-18(13-11-16)21(27)30-20-9-5-4-8-19(20)22(28)29-15-17-6-2-1-3-7-17/h1-9,16,18H,10-15H2,(H4,24,25,26)


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