4-[tert-butyl-[(4-nitrophenyl)methyl]amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: 4-[tert-butyl-[(4-nitrophenyl)methyl]amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: 4-[tert-butyl-[(4-nitrophenyl)methyl]amino]-4-oxo-but-2-enoic acid CAS Name: 4-[tert-butyl-[(4-nitrophenyl)methyl]amino]-4-oxo-2-butenoic acid IUPAC Name: 4-[tert-butyl-[(4-nitrophenyl)methyl]amino]-4-oxobut-2-enoic acid Traditional Name: 4-[tert-butyl-(4-nitrobenzyl)amino]-4-keto-but-2-enoic acid Formula: C15H18N2O5 MolecularWeight: 306.31382

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18N2O5/c1-15(2,3)16(13(18)8-9-14(19)20)10-11-4-6-12(7-5-11)17(21)22/h4-9H,10H2,1-3H3,(H,19,20)