N-[3-[methyl-[(4-prop-2-enoxyphenyl)methyl]amino]-3-oxidanylidene-propyl]-4-nitro-benzamide

Systemtic Name: N-[3-[methyl-[(4-prop-2-enoxyphenyl)methyl]amino]-3-oxidanylidene-propyl]-4-nitro-benzamide Openeye Name: N-[3-[(4-allyloxyphenyl)methyl-methyl-amino]-3-oxo-propyl]-4-nitro-benzamide CAS Name: N-[3-[methyl-[(4-prop-2-enoxyphenyl)methyl]amino]-3-oxopropyl]-4-nitrobenzamide IUPAC Name: N-[3-[methyl-[(4-prop-2-enoxyphenyl)methyl]amino]-3-oxopropyl]-4-nitrobenzamide Traditional Name: N-[3-[(4-allyloxybenzyl)-methyl-amino]-3-keto-propyl]-4-nitro-benzamide Formula: C21H23N3O5 MolecularWeight: 397.42442

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)OCC=C)C(=O)CCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC=C(C=C1)OCC=C)C(=O)CCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C21H23N3O5/c1-3-14-29-19-10-4-16(5-11-19)15-23(2)20(25)12-13-22-21(26)17-6-8-18(9-7-17)24(27)28/h3-11H,1,12-15H2,2H3,(H,22,26)