4-isothiocyanato-3-oxidanyl-N-phenyl-1-tetradecoxy-naphthalene-2-carboxamide

Systemtic Name: 4-isothiocyanato-3-oxidanyl-N-phenyl-1-tetradecoxy-naphthalene-2-carboxamide Openeye Name: 3-hydroxy-4-isothiocyanato-N-phenyl-1-tetradecoxy-naphthalene-2-carboxamide CAS Name: 3-hydroxy-4-isothiocyanato-N-phenyl-1-tetradecoxy-2-naphthalenecarboxamide IUPAC Name: 3-hydroxy-4-isothiocyanato-N-phenyl-1-tetradecoxynaphthalene-2-carboxamide Traditional Name: 3-hydroxy-4-isothiocyanato-1-myristyloxy-N-phenyl-2-naphthamide Formula: C32H40N2O3S MolecularWeight: 532.7366

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C(=C(C2=CC=CC=C21)N=C=S)O)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C(=C(C2=CC=CC=C21)N=C=S)O)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C32H40N2O3S/c1-2-3-4-5-6-7-8-9-10-11-12-18-23-37-31-27-22-17-16-21-26(27)29(33-24-38)30(35)28(31)32(36)34-25-19-14-13-15-20-25/h13-17,19-22,35H,2-12,18,23H2,1H3,(H,34,36)