ethyl 2-nitro-2-[(3-piperidin-1-ylphenyl)methylamino]ethanoate

Systemtic Name: ethyl 2-nitro-2-[(3-piperidin-1-ylphenyl)methylamino]ethanoate Openeye Name: ethyl 2-nitro-2-[[3-(1-piperidyl)phenyl]methylamino]acetate CAS Name: 2-nitro-2-[[3-(1-piperidinyl)phenyl]methylamino]acetic acid ethyl ester IUPAC Name: ethyl 2-nitro-2-[(3-piperidin-1-ylphenyl)methylamino]acetate Traditional Name: 2-nitro-2-[(3-piperidinobenzyl)amino]acetic acid ethyl ester Formula: C16H23N3O4 MolecularWeight: 321.37152

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(NCC1=CC(=CC=C1)N2CCCCC2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C(NCC1=CC(=CC=C1)N2CCCCC2)[N+](=O)[O-]

InChI

InChI=1S/C16H23N3O4/c1-2-23-16(20)15(19(21)22)17-12-13-7-6-8-14(11-13)18-9-4-3-5-10-18/h6-8,11,15,17H,2-5,9-10,12H2,1H3