2-(octylamino)ethyl 4-nitrobenzoate

Systemtic Name: 2-(octylamino)ethyl 4-nitrobenzoate Openeye Name: 2-(octylamino)ethyl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid 2-(octylamino)ethyl ester IUPAC Name: 2-(octylamino)ethyl 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid 2-(octylamino)ethyl ester Formula: C17H26N2O4 MolecularWeight: 322.39934

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNCCOC(=O)C1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCNCCOC(=O)C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C17H26N2O4/c1-2-3-4-5-6-7-12-18-13-14-23-17(20)15-8-10-16(11-9-15)19(21)22/h8-11,18H,2-7,12-14H2,1H3