4-[ethyl(phenethyl)amino]butyl 3,5-bis(azanyl)benzoate

Systemtic Name: 4-[ethyl(phenethyl)amino]butyl 3,5-bis(azanyl)benzoate Openeye Name: 4-[ethyl(phenethyl)amino]butyl 3,5-diaminobenzoate CAS Name: 3,5-diaminobenzoic acid 4-[ethyl(phenethyl)amino]butyl ester IUPAC Name: 4-[ethyl(phenethyl)amino]butyl 3,5-diaminobenzoate Traditional Name: 3,5-diaminobenzoic acid 4-[ethyl(phenethyl)amino]butyl ester Formula: C21H29N3O2 MolecularWeight: 355.47386

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCCOC(=O)C1=CC(=CC(=C1)N)N)CCC2=CC=CC=C2

Isomeric SMILES

CCN(CCCCOC(=O)C1=CC(=CC(=C1)N)N)CCC2=CC=CC=C2

InChI

InChI=1S/C21H29N3O2/c1-2-24(12-10-17-8-4-3-5-9-17)11-6-7-13-26-21(25)18-14-19(22)16-20(23)15-18/h3-5,8-9,14-16H,2,6-7,10-13,22-23H2,1H3