ethyl 4-azanyl-3-(azepan-1-ylmethyl)benzoate

Systemtic Name: ethyl 4-azanyl-3-(azepan-1-ylmethyl)benzoate Openeye Name: ethyl 4-amino-3-(azepan-1-ylmethyl)benzoate CAS Name: 4-amino-3-(1-azepanylmethyl)benzoic acid ethyl ester IUPAC Name: ethyl 4-amino-3-(azepan-1-ylmethyl)benzoate Traditional Name: 4-amino-3-(azepan-1-ylmethyl)benzoic acid ethyl ester Formula: C16H24N2O2 MolecularWeight: 276.37396

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)N)CN2CCCCCC2

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)N)CN2CCCCCC2

InChI

InChI=1S/C16H24N2O2/c1-2-20-16(19)13-7-8-15(17)14(11-13)12-18-9-5-3-4-6-10-18/h7-8,11H,2-6,9-10,12,17H2,1H3