N-[(E)-[1,4-bis(oxidanylidene)-1-(phenethylamino)dodecan-6-ylidene]amino]-2-oxidanyl-naphthalene-1-carboxamide

Systemtic Name: N-[(E)-[1,4-bis(oxidanylidene)-1-(phenethylamino)dodecan-6-ylidene]amino]-2-oxidanyl-naphthalene-1-carboxamide Openeye Name: N-[(E)-1-[2,5-dioxo-5-(phenethylamino)pentyl]heptylideneamino]-2-hydroxy-naphthalene-1-carboxamide CAS Name: N-[(E)-[1,4-dioxo-1-(phenethylamino)dodecan-6-ylidene]amino]-2-hydroxy-1-naphthalenecarboxamide IUPAC Name: N-[(E)-[1,4-dioxo-1-(phenethylamino)dodecan-6-ylidene]amino]-2-hydroxynaphthalene-1-carboxamide Traditional Name: N-[(E)-1-[2,5-diketo-5-(phenethylamino)pentyl]heptylideneamino]-2-hydroxy-1-naphthamide Formula: C31H37N3O4 MolecularWeight: 515.64318

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=NNC(=O)C1=C(C=CC2=CC=CC=C21)O)CC(=O)CCC(=O)NCCC3=CC=CC=C3

Isomeric SMILES

CCCCCC/C(=N\NC(=O)C1=C(C=CC2=CC=CC=C21)O)/CC(=O)CCC(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C31H37N3O4/c1-2-3-4-8-14-25(22-26(35)17-19-29(37)32-21-20-23-11-6-5-7-12-23)33-34-31(38)30-27-15-10-9-13-24(27)16-18-28(30)36/h5-7,9-13,15-16,18,36H,2-4,8,14,17,19-22H2,1H3,(H,32,37)(H,34,38)/b33-25+