(4-butoxyphenyl) 5-[bis(azanyl)methylideneamino]-1,2,3,4-tetrahydronaphthalene-1-carboxylate

Systemtic Name: (4-butoxyphenyl) 5-[bis(azanyl)methylideneamino]-1,2,3,4-tetrahydronaphthalene-1-carboxylate Openeye Name: (4-butoxyphenyl) 5-guanidinotetralin-1-carboxylate CAS Name: 5-(diaminomethylideneamino)-1,2,3,4-tetrahydronaphthalene-1-carboxylic acid (4-butoxyphenyl) ester IUPAC Name: (4-butoxyphenyl) 5-(diaminomethylideneamino)-1,2,3,4-tetrahydronaphthalene-1-carboxylate Traditional Name: 5-guanidinotetralin-1-carboxylic acid (4-butoxyphenyl) ester Formula: C22H27N3O3 MolecularWeight: 381.46808

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)OC(=O)C2CCCC3=C2C=CC=C3N=C(N)N

Isomeric SMILES

CCCCOC1=CC=C(C=C1)OC(=O)C2CCCC3=C2C=CC=C3N=C(N)N

InChI

InChI=1S/C22H27N3O3/c1-2-3-14-27-15-10-12-16(13-11-15)28-21(26)19-8-4-7-18-17(19)6-5-9-20(18)25-22(23)24/h5-6,9-13,19H,2-4,7-8,14H2,1H3,(H4,23,24,25)