(2R)-N-(2-azanylethyl)-1-(2-methoxyethanoyl)-4-[(4-nitrophenyl)methyl-phenethyl-amino]piperidine-2-carboxamide

Systemtic Name: (2R)-N-(2-azanylethyl)-1-(2-methoxyethanoyl)-4-[(4-nitrophenyl)methyl-phenethyl-amino]piperidine-2-carboxamide Openeye Name: (2R)-N-(2-aminoethyl)-1-(2-methoxyacetyl)-4-[(4-nitrophenyl)methyl-phenethyl-amino]piperidine-2-carboxamide CAS Name: (2R)-N-(2-aminoethyl)-1-(2-methoxy-1-oxoethyl)-4-[(4-nitrophenyl)methyl-phenethylamino]-2-piperidinecarboxamide IUPAC Name: (2R)-N-(2-aminoethyl)-1-(2-methoxyacetyl)-4-[(4-nitrophenyl)methyl-phenethylamino]piperidine-2-carboxamide Traditional Name: (2R)-N-(2-aminoethyl)-1-(2-methoxyacetyl)-4-[(4-nitrobenzyl)-phenethyl-amino]pipecolinamide Formula: C26H35N5O5 MolecularWeight: 497.5866

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Descriptors Computed from Structure

Canonical SMILES:

COCC(=O)N1CCC(CC1C(=O)NCCN)N(CCC2=CC=CC=C2)CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COCC(=O)N1CCC(C[C@@H]1C(=O)NCCN)N(CCC2=CC=CC=C2)CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C26H35N5O5/c1-36-19-25(32)30-16-12-23(17-24(30)26(33)28-14-13-27)29(15-11-20-5-3-2-4-6-20)18-21-7-9-22(10-8-21)31(34)35/h2-10,23-24H,11-19,27H2,1H3,(H,28,33)/t23?,24-/m1/s1