(4-ethoxycarbonylphenyl) 7-[bis(azanyl)methylideneamino]-1,2,3,4-tetrahydronaphthalene-1-carboxylate

Systemtic Name: (4-ethoxycarbonylphenyl) 7-[bis(azanyl)methylideneamino]-1,2,3,4-tetrahydronaphthalene-1-carboxylate Openeye Name: (4-ethoxycarbonylphenyl) 7-guanidinotetralin-1-carboxylate CAS Name: 7-(diaminomethylideneamino)-1,2,3,4-tetrahydronaphthalene-1-carboxylic acid (4-ethoxycarbonylphenyl) ester IUPAC Name: (4-ethoxycarbonylphenyl) 7-(diaminomethylideneamino)-1,2,3,4-tetrahydronaphthalene-1-carboxylate Traditional Name: 7-guanidinotetralin-1-carboxylic acid (4-carbethoxyphenyl) ester Formula: C21H23N3O4 MolecularWeight: 381.42502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)OC(=O)C2CCCC3=C2C=C(C=C3)N=C(N)N

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)OC(=O)C2CCCC3=C2C=C(C=C3)N=C(N)N

InChI

InChI=1S/C21H23N3O4/c1-2-27-19(25)14-7-10-16(11-8-14)28-20(26)17-5-3-4-13-6-9-15(12-18(13)17)24-21(22)23/h6-12,17H,2-5H2,1H3,(H4,22,23,24)