undec-10-enyl 2-[(3,5-dinitrophenyl)carbonylamino]-3-phenyl-propanoate

Systemtic Name: undec-10-enyl 2-[(3,5-dinitrophenyl)carbonylamino]-3-phenyl-propanoate Openeye Name: undec-10-enyl 2-[(3,5-dinitrobenzoyl)amino]-3-phenyl-propanoate CAS Name: 2-[[(3,5-dinitrophenyl)-oxomethyl]amino]-3-phenylpropanoic acid undec-10-enyl ester IUPAC Name: undec-10-enyl 2-[(3,5-dinitrobenzoyl)amino]-3-phenylpropanoate Traditional Name: 2-[(3,5-dinitrobenzoyl)amino]-3-phenyl-propionic acid undec-10-enyl ester Formula: C27H33N3O7 MolecularWeight: 511.56682

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCCCCCCCCOC(=O)C(CC1=CC=CC=C1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C=CCCCCCCCCCOC(=O)C(CC1=CC=CC=C1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C27H33N3O7/c1-2-3-4-5-6-7-8-9-13-16-37-27(32)25(17-21-14-11-10-12-15-21)28-26(31)22-18-23(29(33)34)20-24(19-22)30(35)36/h2,10-12,14-15,18-20,25H,1,3-9,13,16-17H2,(H,28,31)