N-[4-[[[(2S)-2-(2-nitrophenoxy)propanoyl]amino]carbamoyl]phenyl]butanamide

Systemtic Name: N-[4-[[[(2S)-2-(2-nitrophenoxy)propanoyl]amino]carbamoyl]phenyl]butanamide Openeye Name: N-[4-[[[(2S)-2-(2-nitrophenoxy)propanoyl]amino]carbamoyl]phenyl]butanamide CAS Name: N-[4-[[[(2S)-2-(2-nitrophenoxy)-1-oxopropyl]hydrazo]-oxomethyl]phenyl]butanamide IUPAC Name: N-[4-[[[(2S)-2-(2-nitrophenoxy)propanoyl]amino]carbamoyl]phenyl]butanamide Traditional Name: N-[4-[[[(2S)-2-(2-nitrophenoxy)propanoyl]amino]carbamoyl]phenyl]butyramide Formula: C20H22N4O6 MolecularWeight: 414.41188

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=C(C=C1)C(=O)NNC(=O)C(C)OC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CCCC(=O)NC1=CC=C(C=C1)C(=O)NNC(=O)[C@H](C)OC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O6/c1-3-6-18(25)21-15-11-9-14(10-12-15)20(27)23-22-19(26)13(2)30-17-8-5-4-7-16(17)24(28)29/h4-5,7-13H,3,6H2,1-2H3,(H,21,25)(H,22,26)(H,23,27)/t13-/m0/s1