butyl 4-[2,7-bis(azanyl)heptanoyl]benzoate

Systemtic Name: butyl 4-[2,7-bis(azanyl)heptanoyl]benzoate Openeye Name: butyl 4-(2,7-diaminoheptanoyl)benzoate CAS Name: 4-(2,7-diamino-1-oxoheptyl)benzoic acid butyl ester IUPAC Name: butyl 4-(2,7-diaminoheptanoyl)benzoate Traditional Name: 4-(2,7-diaminoheptanoyl)benzoic acid butyl ester Formula: C18H28N2O3 MolecularWeight: 320.42652

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)C(=O)C(CCCCCN)N

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)C(=O)C(CCCCCN)N

InChI

InChI=1S/C18H28N2O3/c1-2-3-13-23-18(22)15-10-8-14(9-11-15)17(21)16(20)7-5-4-6-12-19/h8-11,16H,2-7,12-13,19-20H2,1H3